Ligand source activities (1 row/activity)
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Activity | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
Reference ligand |
Vendors |
Species |
Assay Type |
Activity Type |
Activity Relation |
Activity Value |
p-value (-log) |
Fold selectivity |
Tested GPCRs |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
|
| 168278159 | 190358 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 23 | 4 | ChEMBL | 839 | 15 | 5 | 15 | 6.6 | Nc1sc(-c2ccc(-c3cn(CCCCCCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5177040 | 190358 | None | 0 | Human | Functional | pEC50 | = | 9.5 | 9.5 | 23 | 4 | ChEMBL | 839 | 15 | 5 | 15 | 6.6 | Nc1sc(-c2ccc(-c3cn(CCCCCCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 168278159 | 190358 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 23 | 4 | ChEMBL | 839 | 15 | 5 | 15 | 6.6 | Nc1sc(-c2ccc(-c3cn(CCCCCCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5177040 | 190358 | None | 0 | Human | Functional | pEC50 | = | 9.4 | 9.4 | 23 | 4 | ChEMBL | 839 | 15 | 5 | 15 | 6.6 | Nc1sc(-c2ccc(-c3cn(CCCCCCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 9975036 | 16326 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1cccc(O)c1 | 10.1021/acs.jmedchem.6b00552 | |||
| CHEMBL122806 | 16326 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1cccc(O)c1 | 10.1021/acs.jmedchem.6b00552 | |||
| 9975036 | 16326 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1cccc(O)c1 | 10.1021/jm049947s | |||
| CHEMBL122806 | 16326 | None | 0 | Human | Functional | pEC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1cccc(O)c1 | 10.1021/jm049947s | |||
| 71657835 | 159735 | None | 3 | Human | Functional | pEC50 | = | 8.0 | 8.0 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL4104819 | 159735 | None | 3 | Human | Functional | pEC50 | = | 8.0 | 8.0 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 44423814 | 142096 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 611 | 9 | 5 | 11 | 2.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(Br)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL388193 | 142096 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 611 | 9 | 5 | 11 | 2.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(Br)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 9869857 | 66828 | None | 11 | Human | Functional | pEC50 | = | 6 | 6.0 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL186113 | 66828 | None | 11 | Human | Functional | pEC50 | = | 6 | 6.0 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 49870952 | 58818 | None | 0 | Human | Functional | pEC50 | = | 5 | 5.0 | -831 | 2 | ChEMBL | 333 | 3 | 3 | 8 | 0.9 | CCCCC#Cc1nc(N)c2ncn([C@@H]3SC[C@@H](O)[C@H]3O)c2n1 | 10.1021/ml1001823 | |||
| CHEMBL1688378 | 58818 | None | 0 | Human | Functional | pEC50 | = | 5 | 5.0 | -831 | 2 | ChEMBL | 333 | 3 | 3 | 8 | 0.9 | CCCCC#Cc1nc(N)c2ncn([C@@H]3SC[C@@H](O)[C@H]3O)c2n1 | 10.1021/ml1001823 | |||
| 219024 | 3298 | None | 65 | Human | Functional | pEC50 | = | 5 | 5.0 | -51 | 5 | ChEMBL | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 10.1021/jm4011669 | |||
| 2362 | 3298 | None | 65 | Human | Functional | pEC50 | = | 5 | 5.0 | -51 | 5 | ChEMBL | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 10.1021/jm4011669 | |||
| 5596 | 3298 | None | 65 | Human | Functional | pEC50 | = | 5 | 5.0 | -51 | 5 | ChEMBL | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 10.1021/jm4011669 | |||
| CHEMBL317052 | 3298 | None | 65 | Human | Functional | pEC50 | = | 5 | 5.0 | -51 | 5 | ChEMBL | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 10.1021/jm4011669 | |||
| DB06213 | 3298 | None | 65 | Human | Functional | pEC50 | = | 5 | 5.0 | -51 | 5 | ChEMBL | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 10.1021/jm4011669 | |||
| 9910098 | 70681 | None | 31 | Human | Functional | pEC50 | = | 5 | 5.0 | - | 1 | ChEMBL | 421 | 6 | 4 | 10 | 0.3 | Nc1nc(OCCc2ccc(Cl)cc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm4011669 | |||
| CHEMBL1950553 | 70681 | None | 31 | Human | Functional | pEC50 | = | 5 | 5.0 | - | 1 | ChEMBL | 421 | 6 | 4 | 10 | 0.3 | Nc1nc(OCCc2ccc(Cl)cc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm4011669 | |||
| 118732976 | 118515 | None | 0 | Human | Functional | pEC50 | = | 6 | 6.0 | -213 | 4 | ChEMBL | 427 | 5 | 3 | 12 | 0.4 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N[C@H]5C[C@@H]6CC[C@@H]5C6)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414942 | 118515 | None | 0 | Human | Functional | pEC50 | = | 6 | 6.0 | -213 | 4 | ChEMBL | 427 | 5 | 3 | 12 | 0.4 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N[C@H]5C[C@@H]6CC[C@@H]5C6)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm049947s | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm049947s | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm049947s | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm049947s | |||
| 44423816 | 85216 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 601 | 9 | 5 | 11 | 2.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccccc5C(F)(F)F)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL225579 | 85216 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 601 | 9 | 5 | 11 | 2.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccccc5C(F)(F)F)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 16203542 | 85196 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -3 | 2 | ChEMBL | 504 | 6 | 5 | 10 | 0.9 | Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL225459 | 85196 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -3 | 2 | ChEMBL | 504 | 6 | 5 | 10 | 0.9 | Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 145965471 | 164174 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 376 | 6 | 2 | 7 | 3.5 | CCOc1ccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4210592 | 164174 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 376 | 6 | 2 | 7 | 3.5 | CCOc1ccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| 137659441 | 159097 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -87 | 4 | ChEMBL | 441 | 6 | 3 | 12 | 0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(F)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4097468 | 159097 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -87 | 4 | ChEMBL | 441 | 6 | 3 | 12 | 0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(F)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 123683 | 3119 | None | 63 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1021/jm9804984 | |||
| 422 | 3119 | None | 63 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1021/jm9804984 | |||
| CHEMBL119709 | 3119 | None | 63 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1021/jm9804984 | |||
| DB05511 | 3119 | None | 63 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1021/jm9804984 | |||
| 118732981 | 118520 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -38 | 4 | ChEMBL | 495 | 5 | 3 | 12 | 2.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(Nc5ccc(Cl)cc5F)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414947 | 118520 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -38 | 4 | ChEMBL | 495 | 5 | 3 | 12 | 2.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(Nc5ccc(Cl)cc5F)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 11352497 | 122965 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -416 | 3 | ChEMBL | 498 | 8 | 6 | 15 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(O)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL360837 | 122965 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -416 | 3 | ChEMBL | 498 | 8 | 6 | 15 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(O)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 118732975 | 118514 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -173 | 4 | ChEMBL | 407 | 5 | 3 | 12 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414941 | 118514 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -173 | 4 | ChEMBL | 407 | 5 | 3 | 12 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 132991435 | 180796 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -123 | 4 | ChEMBL | 558 | 8 | 5 | 12 | 0.8 | O=C(NCc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)c1ccc(S(=O)(=O)F)cc1 | 10.1021/acs.jmedchem.6b01561 | |||
| CHEMBL4756472 | 180796 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -123 | 4 | ChEMBL | 558 | 8 | 5 | 12 | 0.8 | O=C(NCc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)c1ccc(S(=O)(=O)F)cc1 | 10.1021/acs.jmedchem.6b01561 | |||
| 57388054 | 75481 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -17 | 4 | ChEMBL | 607 | 12 | 5 | 10 | 3.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042305 | 75481 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -17 | 4 | ChEMBL | 607 | 12 | 5 | 10 | 3.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 135543624 | 16307 | None | 28 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(O)cc1 | 10.1021/jm049947s | |||
| CHEMBL122622 | 16307 | None | 28 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(O)cc1 | 10.1021/jm049947s | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 44423813 | 168747 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 567 | 9 | 5 | 11 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(Cl)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL437168 | 168747 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 567 | 9 | 5 | 11 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(Cl)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 145974358 | 164487 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 455 | 8 | 2 | 7 | 4.3 | N#Cc1c(N)nc(SCc2cccc(C(N)=O)c2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4214347 | 164487 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 455 | 8 | 2 | 7 | 4.3 | N#Cc1c(N)nc(SCc2cccc(C(N)=O)c2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 57387596 | 75487 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -60 | 4 | ChEMBL | 492 | 7 | 4 | 9 | 1.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(F)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042311 | 75487 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -60 | 4 | ChEMBL | 492 | 7 | 4 | 9 | 1.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(F)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 11386951 | 66883 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -389 | 2 | ChEMBL | 527 | 9 | 5 | 16 | -0.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc([N+](=O)[O-])cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL186403 | 66883 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -389 | 2 | ChEMBL | 527 | 9 | 5 | 16 | -0.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc([N+](=O)[O-])cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 57385043 | 75486 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -134 | 4 | ChEMBL | 810 | 18 | 6 | 13 | 6.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)CCCC[C@H]5CCSS5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042310 | 75486 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -134 | 4 | ChEMBL | 810 | 18 | 6 | 13 | 6.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)CCCC[C@H]5CCSS5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 76329266 | 106060 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -3 | 4 | ChEMBL | 399 | 5 | 5 | 10 | -0.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133160 | 106060 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -3 | 4 | ChEMBL | 399 | 5 | 5 | 10 | -0.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 16203665 | 136676 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 456 | 7 | 5 | 11 | 0.1 | COc1ccc2[nH]cc(CCOc3nc(N)c4ncn([C@@H]5O[C@H](CO)[C@@H](O)[C@H]5O)c4n3)c2c1 | 10.1021/jm061278q | |||
| CHEMBL374028 | 136676 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 456 | 7 | 5 | 11 | 0.1 | COc1ccc2[nH]cc(CCOc3nc(N)c4ncn([C@@H]5O[C@H](CO)[C@@H](O)[C@H]5O)c4n3)c2c1 | 10.1021/jm061278q | |||
| 76311197 | 106056 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -31 | 3 | ChEMBL | 365 | 6 | 5 | 10 | -1.0 | CCCCNc1nc(N)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@@H](O)[C@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133156 | 106056 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -31 | 3 | ChEMBL | 365 | 6 | 5 | 10 | -1.0 | CCCCNc1nc(N)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@@H](O)[C@H]1O | 10.1039/C3MD00364G | |||
| 168282699 | 191016 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -12022 | 3 | ChEMBL | 427 | 6 | 4 | 10 | 0.9 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5186757 | 191016 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -12022 | 3 | ChEMBL | 427 | 6 | 4 | 10 | 0.9 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 57387824 | 75475 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -8 | 4 | ChEMBL | 442 | 7 | 6 | 11 | -0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(N)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042299 | 75475 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -8 | 4 | ChEMBL | 442 | 7 | 6 | 11 | -0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(N)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 16203542 | 85196 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 504 | 6 | 5 | 10 | 0.9 | Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL225459 | 85196 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 504 | 6 | 5 | 10 | 0.9 | Nc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 137651756 | 157484 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -91 | 2 | ChEMBL | 355 | 4 | 3 | 9 | -0.1 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(N[C@@H]4CCOC4)ncnc32)[C@@H]1O | 10.1021/acs.jmedchem.7b01399 | |||
| CHEMBL4079464 | 157484 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | -91 | 2 | ChEMBL | 355 | 4 | 3 | 9 | -0.1 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(N[C@@H]4CCOC4)ncnc32)[C@@H]1O | 10.1021/acs.jmedchem.7b01399 | |||
| 137657841 | 159568 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -50 | 4 | ChEMBL | 475 | 6 | 3 | 12 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccc(Cl)cc5F)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4102750 | 159568 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -50 | 4 | ChEMBL | 475 | 6 | 3 | 12 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccc(Cl)cc5F)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 9869857 | 66828 | None | 11 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm4011669 | |||
| CHEMBL186113 | 66828 | None | 11 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm4011669 | |||
| 11352497 | 122965 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -416 | 3 | ChEMBL | 498 | 8 | 6 | 15 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(O)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL360837 | 122965 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -416 | 3 | ChEMBL | 498 | 8 | 6 | 15 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(O)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 11157262 | 123638 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -537 | 3 | ChEMBL | 560 | 8 | 5 | 14 | 0.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Br)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL361925 | 123638 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -537 | 3 | ChEMBL | 560 | 8 | 5 | 14 | 0.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Br)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 71459958 | 79217 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 336 | 3 | 4 | 9 | -0.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=S)NC2CC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2113421 | 79217 | None | 0 | Human | Functional | pEC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 336 | 3 | 4 | 9 | -0.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=S)NC2CC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| 118732978 | 118517 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -154 | 4 | ChEMBL | 403 | 5 | 3 | 13 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CCCO5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414944 | 118517 | None | 0 | Human | Functional | pEC50 | = | 5.9 | 5.9 | -154 | 4 | ChEMBL | 403 | 5 | 3 | 13 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CCCO5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 145977469 | 163990 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 402 | 7 | 2 | 7 | 3.9 | N#Cc1c(N)nc(SCc2cnc[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4208189 | 163990 | None | 0 | Human | Functional | pEC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 402 | 7 | 2 | 7 | 3.9 | N#Cc1c(N)nc(SCc2cnc[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 57387594 | 75480 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -16 | 4 | ChEMBL | 506 | 8 | 4 | 9 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(F)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042304 | 75480 | None | 0 | Human | Functional | pEC50 | = | 7.9 | 7.9 | -16 | 4 | ChEMBL | 506 | 8 | 4 | 9 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(F)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.9 | 6.9 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061278q | |||
| 24827417 | 96345 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 729 | 12 | 6 | 12 | 4.1 | O=C(COc1ccc(Nc2nc(OCCc3c[nH]c4cc(Br)ccc34)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)Nc1ccccc1 | 10.1021/jm701442d | |||
| CHEMBL261546 | 96345 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 729 | 12 | 6 | 12 | 4.1 | O=C(COc1ccc(Nc2nc(OCCc3c[nH]c4cc(Br)ccc34)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)Nc1ccccc1 | 10.1021/jm701442d | |||
| 9954747 | 137109 | None | 15 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 437 | 6 | 4 | 10 | 0.8 | Nc1nc(OCCc2ccc3ccccc3c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL374760 | 137109 | None | 15 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 437 | 6 | 4 | 10 | 0.8 | Nc1nc(OCCc2ccc3ccccc3c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 149362 | 75474 | None | 6 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -12 | 4 | ChEMBL | 427 | 7 | 5 | 10 | -0.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042298 | 75474 | None | 6 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -12 | 4 | ChEMBL | 427 | 7 | 5 | 10 | -0.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 168290627 | 192001 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 3 | 4 | ChEMBL | 859 | 11 | 6 | 13 | 6.6 | Nc1sc(-c2ccc(C(=O)NCCC#Cc3ccc(Nc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5201533 | 192001 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 3 | 4 | ChEMBL | 859 | 11 | 6 | 13 | 6.6 | Nc1sc(-c2ccc(C(=O)NCCC#Cc3ccc(Nc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 137656845 | 159794 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 1 | 3 | ChEMBL | 800 | 15 | 5 | 12 | 6.5 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccc(-c2scc(C(=O)c3ccccc3)c2-c2cccc(C(F)(F)F)c2)cc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4105473 | 159794 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | 1 | 3 | ChEMBL | 800 | 15 | 5 | 12 | 6.5 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccc(-c2scc(C(=O)c3ccccc3)c2-c2cccc(C(F)(F)F)c2)cc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 118732972 | 118511 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -234 | 4 | ChEMBL | 347 | 4 | 3 | 12 | -1.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414938 | 118511 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -234 | 4 | ChEMBL | 347 | 4 | 3 | 12 | -1.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 57384287 | 75477 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -33 | 4 | ChEMBL | 658 | 9 | 6 | 11 | 3.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042301 | 75477 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -33 | 4 | ChEMBL | 658 | 9 | 6 | 11 | 3.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 11776764 | 7897 | None | 15 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 248 | 2 | 1 | 8 | 1.1 | CSc1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1090123 | 7897 | None | 15 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 248 | 2 | 1 | 8 | 1.1 | CSc1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| 44423812 | 85370 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 551 | 9 | 5 | 11 | 1.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(F)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226194 | 85370 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 551 | 9 | 5 | 11 | 1.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(F)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b00047 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b00047 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.8 | 7.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b00047 | |||
| 44423824 | 137583 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 547 | 10 | 5 | 11 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NCc5ccccc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL375501 | 137583 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 547 | 10 | 5 | 11 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NCc5ccccc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmc.2007.01.055 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmc.2007.01.055 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmc.2007.01.055 | |||
| 137649841 | 157428 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -1 | 4 | ChEMBL | 656 | 14 | 5 | 12 | 3.8 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(-c2cc(C(=O)c3ccccc3)cs2)c1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4078771 | 157428 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -1 | 4 | ChEMBL | 656 | 14 | 5 | 12 | 3.8 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(-c2cc(C(=O)c3ccccc3)cs2)c1 | 10.1021/acs.jmedchem.8b00047 | |||
| 76311194 | 106044 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -100 | 4 | ChEMBL | 525 | 5 | 5 | 10 | -0.0 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133078 | 106044 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -100 | 4 | ChEMBL | 525 | 5 | 5 | 10 | -0.0 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 76329263 | 106045 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -39 | 4 | ChEMBL | 413 | 6 | 5 | 10 | -0.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133079 | 106045 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -39 | 4 | ChEMBL | 413 | 6 | 5 | 10 | -0.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCc4ccccc4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 76332919 | 106053 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -316 | 3 | ChEMBL | 323 | 3 | 5 | 10 | -2.2 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133153 | 106053 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -316 | 3 | ChEMBL | 323 | 3 | 5 | 10 | -2.2 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 76336525 | 106054 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -158 | 3 | ChEMBL | 337 | 4 | 5 | 10 | -1.8 | CCNc1nc(N)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@@H](O)[C@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133154 | 106054 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -158 | 3 | ChEMBL | 337 | 4 | 5 | 10 | -1.8 | CCNc1nc(N)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@@H](O)[C@H]1O | 10.1039/C3MD00364G | |||
| 44423821 | 142191 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 589 | 9 | 5 | 11 | 2.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(C(C)(C)C)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL388405 | 142191 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 589 | 9 | 5 | 11 | 2.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(C(C)(C)C)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 72141742 | 162574 | None | 1 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 302 | 5 | 1 | 7 | 0.0 | O=C(CN1CCOC(Cn2cncn2)C1)Nc1cccnc1 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4168653 | 162574 | None | 1 | Human | Functional | pEC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 302 | 5 | 1 | 7 | 0.0 | O=C(CN1CCOC(Cn2cncn2)C1)Nc1cccnc1 | 10.1016/j.ejmech.2017.05.035 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061170a | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061170a | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061170a | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.8 | 6.8 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061170a | |||
| 14157150 | 79227 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 324 | 3 | 4 | 9 | -1.0 | CCNC(=S)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2113431 | 79227 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 324 | 3 | 4 | 9 | -1.0 | CCNC(=S)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| 21893339 | 163910 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 366 | 5 | 3 | 7 | 1.6 | CC(=O)Nc1ccc(-c2c(C#N)c(N)nc(SCC(N)=O)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4207286 | 163910 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 366 | 5 | 3 | 7 | 1.6 | CC(=O)Nc1ccc(-c2c(C#N)c(N)nc(SCC(N)=O)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 137636099 | 155823 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -173 | 4 | ChEMBL | 535 | 6 | 3 | 12 | 1.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Br)c5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4059961 | 155823 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -173 | 4 | ChEMBL | 535 | 6 | 3 | 12 | 1.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Br)c5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 414 | 3380 | None | 33 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -213 | 5 | ChEMBL | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 10.1021/jm061278q | |||
| 93205 | 3380 | None | 33 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -213 | 5 | ChEMBL | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 10.1021/jm061278q | |||
| CHEMBL139000 | 3380 | None | 33 | Human | Functional | pEC50 | = | 5.8 | 5.8 | -213 | 5 | ChEMBL | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 10.1021/jm061278q | |||
| 46885472 | 8331 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 381 | 4 | 2 | 8 | 3.5 | CSc1nc(NC(=O)Nc2ccc(C)cc2)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1092869 | 8331 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 381 | 4 | 2 | 8 | 3.5 | CSc1nc(NC(=O)Nc2ccc(C)cc2)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| 11395785 | 186512 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 410 | 5 | 4 | 9 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.7b00457 | |||
| CHEMBL487754 | 186512 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 410 | 5 | 4 | 9 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.7b00457 | |||
| 168280775 | 191155 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -1096 | 4 | ChEMBL | 524 | 7 | 4 | 10 | 2.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccc(C(C)(C)C)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5188601 | 191155 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | -1096 | 4 | ChEMBL | 524 | 7 | 4 | 10 | 2.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccc(C(C)(C)C)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 137643164 | 158099 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 5 | 4 | ChEMBL | 552 | 12 | 5 | 11 | 2.6 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(-c2cccs2)c1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4086624 | 158099 | None | 0 | Human | Functional | pEC50 | = | 7.8 | 7.8 | 5 | 4 | ChEMBL | 552 | 12 | 5 | 11 | 2.6 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(-c2cccs2)c1 | 10.1021/acs.jmedchem.8b00047 | |||
| 46885471 | 8330 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 367 | 4 | 2 | 8 | 3.1 | CSc1nc(NC(=O)Nc2ccccc2)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1092868 | 8330 | None | 0 | Human | Functional | pEC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 367 | 4 | 2 | 8 | 3.1 | CSc1nc(NC(=O)Nc2ccccc2)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| 24827415 | 159424 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 519 | 7 | 6 | 11 | 0.6 | NNc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm701442d | |||
| CHEMBL410104 | 159424 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 519 | 7 | 6 | 11 | 0.6 | NNc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm701442d | |||
| 16103168 | 83216 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 481 | 6 | 5 | 11 | 0.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(C)s4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL218585 | 83216 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 481 | 6 | 5 | 11 | 0.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(C)s4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 44423837 | 85247 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 581 | 10 | 5 | 11 | 1.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NCc5ccccc5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL225944 | 85247 | None | 0 | Human | Functional | pEC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 581 | 10 | 5 | 11 | 1.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NCc5ccccc5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 44420921 | 85160 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 393 | 6 | 4 | 11 | -0.3 | Nc1nc(OCCc2cccs2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL225233 | 85160 | None | 0 | Human | Functional | pEC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 393 | 6 | 4 | 11 | -0.3 | Nc1nc(OCCc2cccs2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 137649083 | 157305 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 849 | 15 | 6 | 13 | 6.7 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3nc(Cl)nc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4077152 | 157305 | None | 0 | Human | Functional | pEC50 | = | 7.7 | 7.7 | 7 | 3 | ChEMBL | 849 | 15 | 6 | 13 | 6.7 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3nc(Cl)nc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 145968949 | 164815 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 409 | 8 | 3 | 8 | 2.0 | N#Cc1c(N)nc(SCC(=O)NCO)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4218613 | 164815 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 409 | 8 | 3 | 8 | 2.0 | N#Cc1c(N)nc(SCC(=O)NCO)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 16202726 | 84710 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 552 | 6 | 5 | 10 | 0.7 | Nc1nc(OCCc2c[nH]c3ccc(I)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL222748 | 84710 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 552 | 6 | 5 | 10 | 0.7 | Nc1nc(OCCc2c[nH]c3ccc(I)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 11174953 | 16760 | None | 1 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -1 | 2 | ChEMBL | 332 | 4 | 2 | 6 | 3.1 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccccc1 | 10.1021/jm049947s | |||
| CHEMBL124345 | 16760 | None | 1 | Human | Functional | pEC50 | = | 7.7 | 7.7 | -1 | 2 | ChEMBL | 332 | 4 | 2 | 6 | 3.1 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccccc1 | 10.1021/jm049947s | |||
| 168283013 | 190873 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | -3715 | 4 | ChEMBL | 516 | 8 | 4 | 10 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4cccc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5184828 | 190873 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | -3715 | 4 | ChEMBL | 516 | 8 | 4 | 10 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4cccc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 137650899 | 157201 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -35 | 4 | ChEMBL | 413 | 6 | 3 | 13 | 0.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccco5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4076003 | 157201 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -35 | 4 | ChEMBL | 413 | 6 | 3 | 13 | 0.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccco5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 137657926 | 159766 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -269 | 4 | ChEMBL | 421 | 6 | 3 | 12 | 0.3 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCC5CC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4105164 | 159766 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -269 | 4 | ChEMBL | 421 | 6 | 3 | 12 | 0.3 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCC5CC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 76322076 | 106046 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -39 | 4 | ChEMBL | 489 | 7 | 5 | 10 | 1.0 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133080 | 106046 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -39 | 4 | ChEMBL | 489 | 7 | 5 | 10 | 1.0 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 76318403 | 106057 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -39 | 4 | ChEMBL | 363 | 4 | 5 | 10 | -1.3 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCC4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133157 | 106057 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -39 | 4 | ChEMBL | 363 | 4 | 5 | 10 | -1.3 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCC4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 57387337 | 75473 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | -6 | 4 | ChEMBL | 326 | 3 | 4 | 9 | -1.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(F)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042297 | 75473 | None | 0 | Human | Functional | pEC50 | = | 8.6 | 8.6 | -6 | 4 | ChEMBL | 326 | 3 | 4 | 9 | -1.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(F)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 16103185 | 166041 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 467 | 6 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4cccs4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL425643 | 166041 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 467 | 6 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4cccs4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 70689262 | 77975 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -954 | 3 | ChEMBL | 496 | 8 | 4 | 14 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL2096798 | 77975 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -954 | 3 | ChEMBL | 496 | 8 | 4 | 14 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 137656913 | 159651 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | -371 | 2 | ChEMBL | 389 | 4 | 3 | 9 | 0.5 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@@H]1O | 10.1021/acs.jmedchem.7b01399 | |||
| CHEMBL4103712 | 159651 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | -371 | 2 | ChEMBL | 389 | 4 | 3 | 9 | 0.5 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@@H]1O | 10.1021/acs.jmedchem.7b01399 | |||
| 46885518 | 7796 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 427 | 5 | 2 | 8 | 4.5 | Cc1ccc(NC(=O)Nc2nc(Oc3ccccc3)nc3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1089441 | 7796 | None | 0 | Human | Functional | pEC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 427 | 5 | 2 | 8 | 4.5 | Cc1ccc(NC(=O)Nc2nc(Oc3ccccc3)nc3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2010.02.039 | |||
| 16109359 | 161776 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -758 | 4 | ChEMBL | 924 | 21 | 6 | 14 | 4.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCNC(=O)CCCCCNC(=O)COc4ccc(/C=C/C5=[N+]6C(=Cc7ccc(-c8cccs8)n7[B-]6(F)F)C=C5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061279i | |||
| CHEMBL414055 | 161776 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -758 | 4 | ChEMBL | 924 | 21 | 6 | 14 | 4.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCNC(=O)CCCCCNC(=O)COc4ccc(/C=C/C5=[N+]6C(=Cc7ccc(-c8cccs8)n7[B-]6(F)F)C=C5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061279i | |||
| 16103167 | 83381 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 451 | 6 | 5 | 11 | -0.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccco4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL219413 | 83381 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 451 | 6 | 5 | 11 | -0.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccco4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 145977114 | 163769 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 367 | 6 | 2 | 7 | 2.3 | CCOc1ccc(-c2c(C#N)c(N)nc(SCC(=O)NC)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4205729 | 163769 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 367 | 6 | 2 | 7 | 2.3 | CCOc1ccc(-c2c(C#N)c(N)nc(SCC(=O)NC)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 137650221 | 157253 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -56 | 4 | ChEMBL | 463 | 6 | 3 | 13 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccs5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4076561 | 157253 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -56 | 4 | ChEMBL | 463 | 6 | 3 | 13 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccs5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 16202727 | 84737 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 460 | 6 | 5 | 10 | 0.8 | Nc1nc(OCCc2c[nH]c3cc(Cl)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL222907 | 84737 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 460 | 6 | 5 | 10 | 0.8 | Nc1nc(OCCc2c[nH]c3cc(Cl)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 16202725 | 84659 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 460 | 6 | 5 | 10 | 0.8 | Nc1nc(OCCc2c[nH]c3ccc(Cl)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL222442 | 84659 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 460 | 6 | 5 | 10 | 0.8 | Nc1nc(OCCc2c[nH]c3ccc(Cl)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 23757284 | 85127 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#C[C@@H](O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061278q | |||
| CHEMBL224874 | 85127 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#C[C@@H](O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061278q | |||
| 118732974 | 118513 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -47 | 4 | ChEMBL | 373 | 5 | 3 | 12 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL3414940 | 118513 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -47 | 4 | ChEMBL | 373 | 5 | 3 | 12 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 137650918 | 157243 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -6 | 4 | ChEMBL | 671 | 14 | 6 | 13 | 3.4 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)cc1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4076495 | 157243 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -6 | 4 | ChEMBL | 671 | 14 | 6 | 13 | 3.4 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)cc1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 132991434 | 179956 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -23 | 4 | ChEMBL | 564 | 8 | 6 | 12 | 2.4 | OC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(CNC(=S)Nc5ccc(N=C=S)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.6b01561 | |||
| CHEMBL4746617 | 179956 | None | 0 | Human | Functional | pEC50 | = | 6.7 | 6.7 | -23 | 4 | ChEMBL | 564 | 8 | 6 | 12 | 2.4 | OC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(CNC(=S)Nc5ccc(N=C=S)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.6b01561 | |||
| 137651747 | 157479 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -70 | 4 | ChEMBL | 475 | 6 | 3 | 12 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(F)c5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4079433 | 157479 | None | 0 | Human | Functional | pEC50 | = | 5.7 | 5.7 | -70 | 4 | ChEMBL | 475 | 6 | 3 | 12 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(F)c5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 16103178 | 160656 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 431 | 6 | 5 | 11 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(C)o4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL411332 | 160656 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 431 | 6 | 5 | 11 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(C)o4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 57384543 | 75484 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -6 | 4 | ChEMBL | 838 | 14 | 6 | 11 | 7.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042308 | 75484 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -6 | 4 | ChEMBL | 838 | 14 | 6 | 11 | 7.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 449 | 2641 | None | 52 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2017.05.035 | |||
| 453 | 2641 | None | 52 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2017.05.035 | |||
| 6603931 | 2641 | None | 52 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Functional | pEC50 | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2017.05.035 | |||
| 136015813 | 162362 | None | 4 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 322 | 6 | 2 | 7 | 2.6 | CCCc1cc(O)nc(SC(C)C(=O)Nc2cc(C)no2)n1 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4165135 | 162362 | None | 4 | Human | Functional | pEC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 322 | 6 | 2 | 7 | 2.6 | CCCc1cc(O)nc(SC(C)C(=O)Nc2cc(C)no2)n1 | 10.1016/j.ejmech.2017.05.035 | |||
| 168273986 | 190174 | None | 0 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -234422 | 2 | ChEMBL | 505 | 6 | 4 | 10 | 1.6 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Br)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5174052 | 190174 | None | 0 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -234422 | 2 | ChEMBL | 505 | 6 | 4 | 10 | 1.6 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Br)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 137648928 | 157403 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -97 | 4 | ChEMBL | 549 | 6 | 3 | 12 | 1.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(I)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4078479 | 157403 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -97 | 4 | ChEMBL | 549 | 6 | 3 | 12 | 1.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(I)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 2844 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b00828 | |||
| 60961 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b00828 | |||
| 90 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b00828 | |||
| CHEMBL477 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b00828 | |||
| DB00640 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b00828 | |||
| 137661132 | 159173 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -316 | 4 | ChEMBL | 491 | 6 | 3 | 12 | 1.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Cl)c5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4098377 | 159173 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -316 | 4 | ChEMBL | 491 | 6 | 3 | 12 | 1.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Cl)c5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 44423825 | 85398 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 577 | 11 | 5 | 12 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NCc5ccc(OC)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226304 | 85398 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 577 | 11 | 5 | 12 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NCc5ccc(OC)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/s0960-894x(01)00347-x | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/s0960-894x(01)00347-x | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/s0960-894x(01)00347-x | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/s0960-894x(01)00347-x | |||
| 2844 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2011.02.053 | |||
| 60961 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2011.02.053 | |||
| 90 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL477 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2011.02.053 | |||
| DB00640 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2011.02.053 | |||
| 2844 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2010.05.056 | |||
| 60961 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2010.05.056 | |||
| 90 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL477 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2010.05.056 | |||
| DB00640 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2010.05.056 | |||
| 2844 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| 60961 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| 90 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| CHEMBL477 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| DB00640 | 283 | None | 107 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| 168278159 | 190358 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 23 | 4 | ChEMBL | 839 | 15 | 5 | 15 | 6.6 | Nc1sc(-c2ccc(-c3cn(CCCCCCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5177040 | 190358 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | 23 | 4 | ChEMBL | 839 | 15 | 5 | 15 | 6.6 | Nc1sc(-c2ccc(-c3cn(CCCCCCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 76325694 | 106059 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -39 | 4 | ChEMBL | 391 | 4 | 5 | 10 | -0.5 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCCC4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133159 | 106059 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -39 | 4 | ChEMBL | 391 | 4 | 5 | 10 | -0.5 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCCC4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 57388055 | 75482 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -40 | 4 | ChEMBL | 622 | 12 | 6 | 11 | 3.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(N)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042306 | 75482 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | -40 | 4 | ChEMBL | 622 | 12 | 6 | 11 | 3.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(N)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 137641990 | 158077 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 4 | ChEMBL | 447 | 6 | 3 | 13 | 0.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccco5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4086325 | 158077 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | -48 | 4 | ChEMBL | 447 | 6 | 3 | 13 | 0.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccco5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 16204411 | 84745 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 376 | 6 | 5 | 10 | -1.0 | Nc1nc(OCCc2cc[nH]c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL222945 | 84745 | None | 0 | Human | Functional | pEC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 376 | 6 | 5 | 10 | -1.0 | Nc1nc(OCCc2cc[nH]c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 168290340 | 191891 | None | 0 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -7943 | 3 | ChEMBL | 475 | 7 | 4 | 10 | 1.6 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5199871 | 191891 | None | 0 | Human | Functional | pEC50 | = | 4.6 | 4.6 | -7943 | 3 | ChEMBL | 475 | 7 | 4 | 10 | 1.6 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 16103165 | 83380 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 447 | 6 | 5 | 11 | -0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(C)s4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL219411 | 83380 | None | 0 | Human | Functional | pEC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 447 | 6 | 5 | 11 | -0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(C)s4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 137639588 | 156882 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccccc2C(=O)NCCCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4072009 | 156882 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccccc2C(=O)NCCCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 24827289 | 167421 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 613 | 9 | 6 | 12 | 1.7 | O=C(NNc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccco1 | 10.1021/jm701442d | |||
| CHEMBL429684 | 167421 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 613 | 9 | 6 | 12 | 1.7 | O=C(NNc1nc(OCCc2c[nH]c3cc(Br)ccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccco1 | 10.1021/jm701442d | |||
| 3044933 | 16481 | None | 6 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 322 | 4 | 4 | 9 | -1.4 | CCCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| CHEMBL1235128 | 16481 | None | 6 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 322 | 4 | 4 | 9 | -1.4 | CCCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| 57388056 | 75483 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -9 | 4 | ChEMBL | 685 | 12 | 5 | 10 | 4.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(Br)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042307 | 75483 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -9 | 4 | ChEMBL | 685 | 12 | 5 | 10 | 4.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(Br)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 16203429 | 84805 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 426 | 6 | 5 | 10 | 0.1 | Nc1nc(OCCc2c[nH]c3ccccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL223366 | 84805 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 426 | 6 | 5 | 10 | 0.1 | Nc1nc(OCCc2c[nH]c3ccccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1039/C3MD00364G | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1039/C3MD00364G | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1039/C3MD00364G | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.5 | 8.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1039/C3MD00364G | |||
| 44423815 | 85382 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 659 | 9 | 5 | 11 | 1.9 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(I)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226242 | 85382 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 659 | 9 | 5 | 11 | 1.9 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(I)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 44423822 | 85397 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 618 | 10 | 5 | 13 | 1.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(N6CCOCC6)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226303 | 85397 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 618 | 10 | 5 | 13 | 1.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(N6CCOCC6)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 70689262 | 77975 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -954 | 3 | ChEMBL | 496 | 8 | 4 | 14 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL2096798 | 77975 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -954 | 3 | ChEMBL | 496 | 8 | 4 | 14 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 71456259 | 79231 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 376 | 4 | 4 | 9 | -0.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCC(F)(F)F)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2113435 | 79231 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 376 | 4 | 4 | 9 | -0.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCC(F)(F)F)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| 44423838 | 142275 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 573 | 9 | 5 | 11 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NC5CCCCC5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL388505 | 142275 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 573 | 9 | 5 | 11 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NC5CCCCC5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 11717831 | 584 | None | 48 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 10.1016/j.ejmech.2018.02.081 | |||
| 3289 | 584 | None | 48 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4202825 | 584 | None | 48 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 10.1016/j.ejmech.2018.02.081 | |||
| 123683 | 3119 | None | 63 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1039/C3MD00364G | |||
| 422 | 3119 | None | 63 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1039/C3MD00364G | |||
| CHEMBL119709 | 3119 | None | 63 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1039/C3MD00364G | |||
| DB05511 | 3119 | None | 63 | Human | Functional | pEC50 | = | 7.5 | 7.5 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1039/C3MD00364G | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9804984 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9804984 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9804984 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9804984 | |||
| 44423826 | 85400 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 539 | 9 | 5 | 11 | 1.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NC5CCCCC5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226307 | 85400 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 539 | 9 | 5 | 11 | 1.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)NC5CCCCC5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 118732979 | 118518 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -426 | 4 | ChEMBL | 437 | 5 | 3 | 13 | 0.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CCCO5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414945 | 118518 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -426 | 4 | ChEMBL | 437 | 5 | 3 | 13 | 0.0 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CCCO5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 44423823 | 142193 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 534 | 9 | 5 | 12 | 0.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccncc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL388406 | 142193 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 534 | 9 | 5 | 12 | 0.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccncc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 44423817 | 85383 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 563 | 10 | 5 | 12 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(OC)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226243 | 85383 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 563 | 10 | 5 | 12 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(OC)cc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 10688700 | 76930 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 342 | 4 | 4 | 9 | -1.6 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCCl)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2070399 | 76930 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 342 | 4 | 4 | 9 | -1.6 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCCl)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| 16203668 | 96338 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 454 | 8 | 5 | 10 | 1.0 | CCNc1nc(OCCc2c[nH]c3ccccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL261515 | 96338 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 454 | 8 | 5 | 10 | 1.0 | CCNc1nc(OCCc2c[nH]c3ccccc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm4011669 | |||
| 10449535 | 76932 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | -2187 | 3 | ChEMBL | 334 | 3 | 4 | 9 | -1.3 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CCC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2070507 | 76932 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | -2187 | 3 | ChEMBL | 334 | 3 | 4 | 9 | -1.3 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CCC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 145967103 | 164135 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 376 | 6 | 2 | 7 | 3.5 | CCOc1ccc(-c2c(C#N)c(N)nc(SCc3ccn[nH]3)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4210096 | 164135 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 376 | 6 | 2 | 7 | 3.5 | CCOc1ccc(-c2c(C#N)c(N)nc(SCc3ccn[nH]3)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 127043828 | 141123 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 538 | 15 | 0 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3827331 | 141123 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 538 | 15 | 0 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 15729982 | 7898 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 245 | 2 | 1 | 8 | 0.4 | CN(C)c1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1090124 | 7898 | None | 0 | Human | Functional | pEC50 | = | 4.5 | 4.5 | - | 1 | ChEMBL | 245 | 2 | 1 | 8 | 0.4 | CN(C)c1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1016/j.bmc.2010.02.039 | |||
| 11256992 | 17942 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 362 | 5 | 2 | 7 | 3.1 | COc1cccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)c1 | 10.1021/jm049947s | |||
| CHEMBL125979 | 17942 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 362 | 5 | 2 | 7 | 3.1 | COc1cccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)c1 | 10.1021/jm049947s | |||
| 51112335 | 162233 | None | 6 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 311 | 4 | 2 | 6 | 2.4 | Cc1cc(NC(=O)CNc2ccc3c(c2)OC(F)(F)O3)on1 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4163380 | 162233 | None | 6 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 311 | 4 | 2 | 6 | 2.4 | Cc1cc(NC(=O)CNc2ccc3c(c2)OC(F)(F)O3)on1 | 10.1016/j.ejmech.2017.05.035 | |||
| 56783276 | 162469 | None | 3 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 319 | 6 | 1 | 7 | 1.6 | CC(C)c1noc(OCC(=O)NCc2ccc3c(c2)OCO3)n1 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4167064 | 162469 | None | 3 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 319 | 6 | 1 | 7 | 1.6 | CC(C)c1noc(OCC(=O)NCc2ccc3c(c2)OCO3)n1 | 10.1016/j.ejmech.2017.05.035 | |||
| 16103186 | 158846 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 481 | 6 | 5 | 11 | 0.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4sccc4C)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL409483 | 158846 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 481 | 6 | 5 | 11 | 0.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4sccc4C)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 3071852 | 8395 | None | 7 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 294 | 3 | 1 | 8 | 2.2 | Nc1nc(Oc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1093313 | 8395 | None | 7 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 294 | 3 | 1 | 8 | 2.2 | Nc1nc(Oc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2010.02.039 | |||
| 145965011 | 164198 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 470 | 8 | 1 | 8 | 4.9 | COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccc(OCC4CC4)cc3)c2C#N)c1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4210852 | 164198 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 470 | 8 | 1 | 8 | 4.9 | COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3ccc(OCC4CC4)cc3)c2C#N)c1 | 10.1016/j.ejmech.2018.02.081 | |||
| 118732971 | 118509 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -147 | 4 | ChEMBL | 333 | 3 | 3 | 12 | -1.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414936 | 118509 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -147 | 4 | ChEMBL | 333 | 3 | 3 | 12 | -1.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 131432 | 137055 | None | 12 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 387 | 6 | 4 | 10 | -0.4 | Nc1nc(OCCc2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL374685 | 137055 | None | 12 | Human | Functional | pEC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 387 | 6 | 4 | 10 | -0.4 | Nc1nc(OCCc2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 137661505 | 159494 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2cccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4101850 | 159494 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | 2 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2cccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 44423820 | 142097 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 577 | 9 | 5 | 13 | 1.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc6c(c5)OCO6)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL388194 | 142097 | None | 0 | Human | Functional | pEC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 577 | 9 | 5 | 13 | 1.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc6c(c5)OCO6)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 118732973 | 118512 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -446 | 4 | ChEMBL | 381 | 4 | 3 | 12 | -0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414939 | 118512 | None | 0 | Human | Functional | pEC50 | = | 5.5 | 5.5 | -446 | 4 | ChEMBL | 381 | 4 | 3 | 12 | -0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 57387825 | 75476 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -8 | 4 | ChEMBL | 505 | 7 | 5 | 10 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(Br)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042300 | 75476 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | -8 | 4 | ChEMBL | 505 | 7 | 5 | 10 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(Br)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 16103187 | 83295 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 450 | 6 | 6 | 10 | -0.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc[nH]4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL218989 | 83295 | None | 0 | Human | Functional | pEC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 450 | 6 | 6 | 10 | -0.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc[nH]4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 44423828 | 85399 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 597 | 10 | 5 | 12 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(OC)cc5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226305 | 85399 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 597 | 10 | 5 | 12 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(OC)cc5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061279i | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061279i | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061279i | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm061279i | |||
| 16203540 | 84624 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 504 | 6 | 5 | 10 | 0.9 | Nc1nc(OCCc2c[nH]c3ccc(Br)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL222194 | 84624 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 504 | 6 | 5 | 10 | 0.9 | Nc1nc(OCCc2c[nH]c3ccc(Br)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 16103177 | 83367 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 495 | 6 | 5 | 11 | -0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(Br)o4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL219361 | 83367 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 495 | 6 | 5 | 11 | -0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccc(Br)o4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 21128750 | 201661 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 322 | 3 | 4 | 9 | -1.4 | CC(C)NC(=O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| CHEMBL606095 | 201661 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 322 | 3 | 4 | 9 | -1.4 | CC(C)NC(=O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| 137658761 | 159180 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -66 | 3 | ChEMBL | 413 | 4 | 3 | 8 | 2.2 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(Nc4ccc(Cl)cc4F)ncnc32)[C@@H]1O | 10.1021/acs.jmedchem.7b01399 | |||
| CHEMBL4098408 | 159180 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -66 | 3 | ChEMBL | 413 | 4 | 3 | 8 | 2.2 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(Nc4ccc(Cl)cc4F)ncnc32)[C@@H]1O | 10.1021/acs.jmedchem.7b01399 | |||
| 145975919 | 163863 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 353 | 6 | 2 | 7 | 2.1 | CCOc1ccc(-c2c(C#N)c(N)nc(SCC(N)=O)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4206762 | 163863 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 353 | 6 | 2 | 7 | 2.1 | CCOc1ccc(-c2c(C#N)c(N)nc(SCC(N)=O)c2C#N)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2009.11.131 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2009.11.131 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2009.11.131 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2009.11.131 | |||
| 168269860 | 189974 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -17782 | 3 | ChEMBL | 512 | 9 | 4 | 11 | 1.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4cccc(OC)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5170857 | 189974 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -17782 | 3 | ChEMBL | 512 | 9 | 4 | 11 | 1.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4cccc(OC)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 118734376 | 118636 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -14 | 2 | ChEMBL | 602 | 10 | 4 | 12 | 1.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(N4CCN(c5ccc(OCCCc6ccccc6)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| CHEMBL3416810 | 118636 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -14 | 2 | ChEMBL | 602 | 10 | 4 | 12 | 1.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(N4CCN(c5ccc(OCCCc6ccccc6)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| 3086599 | 903 | None | 45 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -1 | 6 | ChEMBL | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10.1039/C3MD00364G | |||
| 375 | 903 | None | 45 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -1 | 6 | ChEMBL | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10.1039/C3MD00364G | |||
| 424 | 903 | None | 45 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -1 | 6 | ChEMBL | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10.1039/C3MD00364G | |||
| CHEMBL331372 | 903 | None | 45 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -1 | 6 | ChEMBL | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10.1039/C3MD00364G | |||
| 76336527 | 106061 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -630 | 4 | ChEMBL | 433 | 5 | 5 | 10 | 0.0 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4cccc(Cl)c4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133161 | 106061 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -630 | 4 | ChEMBL | 433 | 5 | 5 | 10 | 0.0 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4cccc(Cl)c4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 71657835 | 159735 | None | 3 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL4104819 | 159735 | None | 3 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c00320 | |||
| 57384544 | 75485 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -57 | 4 | ChEMBL | 854 | 14 | 7 | 12 | 7.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042309 | 75485 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -57 | 4 | ChEMBL | 854 | 14 | 7 | 12 | 7.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 137647420 | 157699 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -194 | 4 | ChEMBL | 501 | 6 | 3 | 12 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Br)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4081876 | 157699 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -194 | 4 | ChEMBL | 501 | 6 | 3 | 12 | 1.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Br)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 44423827 | 85411 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 567 | 9 | 5 | 11 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccccc5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226356 | 85411 | None | 0 | Human | Functional | pEC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 567 | 9 | 5 | 11 | 2.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccccc5)cc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.6b01561 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.6b01561 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.6b01561 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.4 | 7.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.6b01561 | |||
| 46885404 | 8021 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 396 | 6 | 1 | 9 | 2.7 | COc1ccc(CC(=O)Nc2nc(SC)nc3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1090806 | 8021 | None | 0 | Human | Functional | pEC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 396 | 6 | 1 | 9 | 2.7 | COc1ccc(CC(=O)Nc2nc(SC)nc3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2010.02.039 | |||
| 168293442 | 192133 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -17782 | 4 | ChEMBL | 546 | 7 | 4 | 10 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Br)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5203632 | 192133 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -17782 | 4 | ChEMBL | 546 | 7 | 4 | 10 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Br)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 168297905 | 192429 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -2041 | 4 | ChEMBL | 516 | 8 | 4 | 10 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5208245 | 192429 | None | 0 | Human | Functional | pEC50 | = | 5.4 | 5.4 | -2041 | 4 | ChEMBL | 516 | 8 | 4 | 10 | 1.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4OCc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 137646655 | 157624 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -6 | 4 | ChEMBL | 711 | 13 | 6 | 12 | 4.8 | Nc1cc(-c2cccc(C(F)(F)F)c2)c(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)s1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4081224 | 157624 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | -6 | 4 | ChEMBL | 711 | 13 | 6 | 12 | 4.8 | Nc1cc(-c2cccc(C(F)(F)F)c2)c(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)s1 | 10.1021/acs.jmedchem.8b00047 | |||
| 44423818 | 85384 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 593 | 11 | 5 | 13 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(OC)c(OC)c5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226244 | 85384 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 593 | 11 | 5 | 13 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccc(OC)c(OC)c5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 16103184 | 83294 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 467 | 6 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccsc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL218988 | 83294 | None | 0 | Human | Functional | pEC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 467 | 6 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccsc4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 3042985 | 79230 | None | 2 | Human | Functional | pEC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 310 | 3 | 4 | 10 | -2.3 | CONC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2113434 | 79230 | None | 2 | Human | Functional | pEC50 | = | 4.4 | 4.4 | - | 1 | ChEMBL | 310 | 3 | 4 | 10 | -2.3 | CONC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| 98567 | 191779 | None | 18 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -1174 | 3 | ChEMBL | 294 | 2 | 4 | 9 | -2.2 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| CHEMBL519809 | 191779 | None | 18 | Human | Functional | pEC50 | = | 4.4 | 4.4 | -1174 | 3 | ChEMBL | 294 | 2 | 4 | 9 | -2.2 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9804984 | |||
| 16365293 | 162896 | None | 3 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 344 | 5 | 2 | 8 | 0.6 | CC(OC(=O)c1nccnc1N)C(=O)NCc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4173768 | 162896 | None | 3 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 344 | 5 | 2 | 8 | 0.6 | CC(OC(=O)c1nccnc1N)C(=O)NCc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2017.05.035 | |||
| 137652475 | 157143 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -6 | 4 | ChEMBL | 829 | 16 | 6 | 13 | 6.5 | Nc1sc(-c2ccc(C(=O)NCCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4075186 | 157143 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -6 | 4 | ChEMBL | 829 | 16 | 6 | 13 | 6.5 | Nc1sc(-c2ccc(C(=O)NCCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 10256007 | 122927 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -47 | 2 | ChEMBL | 516 | 8 | 5 | 14 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Cl)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL360646 | 122927 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -47 | 2 | ChEMBL | 516 | 8 | 5 | 14 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Cl)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 10388920 | 69822 | None | 7 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 447 | 7 | 4 | 9 | 1.7 | OC[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acsmedchemlett.0c00509 | |||
| CHEMBL193692 | 69822 | None | 7 | Human | Functional | pEC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 447 | 7 | 4 | 9 | 1.7 | OC[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acsmedchemlett.0c00509 | |||
| 168285984 | 191740 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -5248 | 4 | ChEMBL | 461 | 6 | 4 | 10 | 1.5 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5197358 | 191740 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -5248 | 4 | ChEMBL | 461 | 6 | 4 | 10 | 1.5 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 76336526 | 106055 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -501 | 3 | ChEMBL | 351 | 5 | 5 | 10 | -1.4 | CCCNc1nc(N)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@@H](O)[C@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133155 | 106055 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -501 | 3 | ChEMBL | 351 | 5 | 5 | 10 | -1.4 | CCCNc1nc(N)nc2c1ncn2[C@@H]1O[C@H](C(=O)NC)[C@@H](O)[C@H]1O | 10.1039/C3MD00364G | |||
| 145972065 | 164540 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 403 | 7 | 2 | 8 | 3.3 | N#Cc1c(N)nc(SCc2ncn[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4215091 | 164540 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 403 | 7 | 2 | 8 | 3.3 | N#Cc1c(N)nc(SCc2ncn[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 9869857 | 66828 | None | 11 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1016/j.bmcl.2009.11.131 | |||
| CHEMBL186113 | 66828 | None | 11 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1016/j.bmcl.2009.11.131 | |||
| 168297825 | 192281 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -8317 | 4 | ChEMBL | 461 | 6 | 4 | 10 | 1.5 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5205907 | 192281 | None | 0 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -8317 | 4 | ChEMBL | 461 | 6 | 4 | 10 | 1.5 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 168286257 | 191594 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 6 | 4 | ChEMBL | 863 | 14 | 6 | 13 | 6.3 | Nc1sc(-c2ccc(C(=O)NCCc3ccc(CCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5195260 | 191594 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | 6 | 4 | ChEMBL | 863 | 14 | 6 | 13 | 6.3 | Nc1sc(-c2ccc(C(=O)NCCc3ccc(CCNc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 2844 | 283 | None | 107 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| 60961 | 283 | None | 107 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| 90 | 283 | None | 107 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL477 | 283 | None | 107 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| DB00640 | 283 | None | 107 | Human | Functional | pEC50 | = | 7.3 | 7.3 | -16 | 5 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| 168293183 | 192124 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | 1 | 3 | ChEMBL | 767 | 16 | 6 | 13 | 4.7 | Nc1sc(CCC(=O)NCCCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5203535 | 192124 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | 1 | 3 | ChEMBL | 767 | 16 | 6 | 13 | 4.7 | Nc1sc(CCC(=O)NCCCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 137642153 | 158366 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -35 | 4 | ChEMBL | 429 | 6 | 3 | 13 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccs5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4089741 | 158366 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -35 | 4 | ChEMBL | 429 | 6 | 3 | 13 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccs5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 44423819 | 85385 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 593 | 11 | 5 | 13 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5cc(OC)cc(OC)c5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226245 | 85385 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 593 | 11 | 5 | 13 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5cc(OC)cc(OC)c5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 118732980 | 118519 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -63 | 4 | ChEMBL | 461 | 5 | 3 | 12 | 1.4 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(Nc5ccc(Cl)cc5F)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414946 | 118519 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -63 | 4 | ChEMBL | 461 | 5 | 3 | 12 | 1.4 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(Nc5ccc(Cl)cc5F)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 10403711 | 96331 | None | 33 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -501 | 3 | ChEMBL | 320 | 3 | 4 | 9 | -1.7 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| CHEMBL261482 | 96331 | None | 33 | Human | Functional | pEC50 | = | 5.3 | 5.3 | -501 | 3 | ChEMBL | 320 | 3 | 4 | 9 | -1.7 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| 44420926 | 138062 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 350 | 4 | 6 | 9 | -2.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC(=N)N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061278q | |||
| CHEMBL376542 | 138062 | None | 0 | Human | Functional | pEC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 350 | 4 | 6 | 9 | -2.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC(=N)N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061278q | |||
| 215610 | 76933 | None | 4 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -239 | 2 | ChEMBL | 348 | 3 | 4 | 9 | -0.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CCCC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| CHEMBL2070508 | 76933 | None | 4 | Human | Functional | pEC50 | = | 4.3 | 4.3 | -239 | 2 | ChEMBL | 348 | 3 | 4 | 9 | -0.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CCCC2)[C@@H](O)[C@H]1O | 10.1021/jm9804984 | |||
| 56627882 | 118510 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -141 | 4 | ChEMBL | 367 | 3 | 3 | 12 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414937 | 118510 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -141 | 4 | ChEMBL | 367 | 3 | 3 | 12 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 11157262 | 123638 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -537 | 3 | ChEMBL | 560 | 8 | 5 | 14 | 0.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Br)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL361925 | 123638 | None | 0 | Human | Functional | pEC50 | = | 6.3 | 6.3 | -537 | 3 | ChEMBL | 560 | 8 | 5 | 14 | 0.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Br)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 137638080 | 156833 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -269 | 4 | ChEMBL | 457 | 6 | 3 | 12 | 1.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Cl)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4071338 | 156833 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -269 | 4 | ChEMBL | 457 | 6 | 3 | 12 | 1.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5cccc(Cl)c5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 168293564 | 192155 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 45 | 4 | ChEMBL | 849 | 13 | 6 | 13 | 6.8 | Nc1sc(-c2ccc(C(=O)NCCCc3ccc(Nc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5203917 | 192155 | None | 0 | Human | Functional | pEC50 | = | 8.2 | 8.2 | 45 | 4 | ChEMBL | 849 | 13 | 6 | 13 | 6.8 | Nc1sc(-c2ccc(C(=O)NCCCc3ccc(Nc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 137653409 | 159035 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -1 | 4 | ChEMBL | 567 | 12 | 6 | 12 | 2.2 | Nc1ccc(-c2cccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2)s1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4096796 | 159035 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -1 | 4 | ChEMBL | 567 | 12 | 6 | 12 | 2.2 | Nc1ccc(-c2cccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2)s1 | 10.1021/acs.jmedchem.8b00047 | |||
| 168288912 | 191626 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -4897 | 4 | ChEMBL | 502 | 7 | 4 | 10 | 1.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5195714 | 191626 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -4897 | 4 | ChEMBL | 502 | 7 | 4 | 10 | 1.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4Cl)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 16103169 | 82668 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 481 | 7 | 5 | 11 | -0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)Cc4cccs4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL217952 | 82668 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 481 | 7 | 5 | 11 | -0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)Cc4cccs4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 57384288 | 75478 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -426 | 4 | ChEMBL | 674 | 9 | 7 | 12 | 3.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042302 | 75478 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -426 | 4 | ChEMBL | 674 | 9 | 7 | 12 | 3.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 118719026 | 115433 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 582 | 13 | 4 | 8 | 2.1 | CC(C)(C)OC(=O)C1CCCN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1 | 10.1021/jm4011669 | |||
| CHEMBL3350613 | 115433 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 582 | 13 | 4 | 8 | 2.1 | CC(C)(C)OC(=O)C1CCCN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1 | 10.1021/jm4011669 | |||
| 137650461 | 157254 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -1 | 4 | ChEMBL | 857 | 16 | 6 | 13 | 6.4 | CC(=O)Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4076565 | 157254 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -1 | 4 | ChEMBL | 857 | 16 | 6 | 13 | 6.4 | CC(=O)Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 137634444 | 156161 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 1 | 3 | ChEMBL | 801 | 14 | 6 | 13 | 5.7 | Nc1sc(-c2ccc(C(=O)NCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4063841 | 156161 | None | 0 | Human | Functional | pEC50 | = | 7.2 | 7.2 | 1 | 3 | ChEMBL | 801 | 14 | 6 | 13 | 5.7 | Nc1sc(-c2ccc(C(=O)NCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.2 | 7.2 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.2c01414 | |||
| 137642036 | 158150 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -177 | 4 | ChEMBL | 387 | 6 | 3 | 12 | -0.4 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCC5CC5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL4087306 | 158150 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -177 | 4 | ChEMBL | 387 | 6 | 3 | 12 | -0.4 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCC5CC5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 57387822 | 75488 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -3 | 3 | ChEMBL | 840 | 13 | 7 | 12 | 6.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042312 | 75488 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -3 | 3 | ChEMBL | 840 | 13 | 7 | 12 | 6.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(NCCc4ccc(NC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 118732974 | 118513 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -47 | 4 | ChEMBL | 373 | 5 | 3 | 12 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414940 | 118513 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -47 | 4 | ChEMBL | 373 | 5 | 3 | 12 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)ncnc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 118732975 | 118514 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -173 | 4 | ChEMBL | 407 | 5 | 3 | 12 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| CHEMBL3414941 | 118514 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -173 | 4 | ChEMBL | 407 | 5 | 3 | 12 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NC5CC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.7b00291 | |||
| 10436433 | 131371 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -478 | 2 | ChEMBL | 512 | 9 | 5 | 15 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL368880 | 131371 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -478 | 2 | ChEMBL | 512 | 9 | 5 | 15 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 44423811 | 85369 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 533 | 9 | 5 | 11 | 1.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccccc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| CHEMBL226193 | 85369 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 533 | 9 | 5 | 11 | 1.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(Nc4ccc(OCC(=O)Nc5ccccc5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.01.055 | |||
| 162645916 | 179494 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -9 | 4 | ChEMBL | 414 | 6 | 4 | 11 | 0.8 | OC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(CN=C=S)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.6b01561 | |||
| CHEMBL4741079 | 179494 | None | 0 | Human | Functional | pEC50 | = | 6.2 | 6.2 | -9 | 4 | ChEMBL | 414 | 6 | 4 | 11 | 0.8 | OC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(CN=C=S)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.6b01561 | |||
| 118734347 | 118609 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -45 | 2 | ChEMBL | 637 | 8 | 5 | 12 | 0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCN4CCN(c5ccc(I)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| CHEMBL3416782 | 118609 | None | 0 | Human | Functional | pEC50 | = | 5.2 | 5.2 | -45 | 2 | ChEMBL | 637 | 8 | 5 | 12 | 0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCN4CCN(c5ccc(I)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| 57384289 | 75479 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -112 | 4 | ChEMBL | 630 | 13 | 6 | 13 | 2.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(NC(=O)CCCC[C@H]5CCSS5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| CHEMBL2042303 | 75479 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -112 | 4 | ChEMBL | 630 | 13 | 6 | 13 | 2.5 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(NC(=O)CCCC[C@H]5CCSS5)cc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm300206u | |||
| 137646828 | 158004 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -1 | 4 | ChEMBL | 856 | 16 | 6 | 13 | 6.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCCCNC(=O)c4ccc(-c5sc(N)c(C(=O)c6ccccc6)c5-c5cccc(C(F)(F)F)c5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4085418 | 158004 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | -1 | 4 | ChEMBL | 856 | 16 | 6 | 13 | 6.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCCCNC(=O)c4ccc(-c5sc(N)c(C(=O)c6ccccc6)c5-c5cccc(C(F)(F)F)c5)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.8b00047 | |||
| 16203539 | 136347 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 444 | 6 | 5 | 10 | 0.3 | Nc1nc(OCCc2c[nH]c3ccc(F)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL373478 | 136347 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 444 | 6 | 5 | 10 | 0.3 | Nc1nc(OCCc2c[nH]c3ccc(F)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 76329265 | 106058 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -50 | 4 | ChEMBL | 377 | 4 | 5 | 10 | -0.9 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| CHEMBL3133158 | 106058 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -50 | 4 | ChEMBL | 377 | 4 | 5 | 10 | -0.9 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(N)nc32)[C@H](O)[C@@H]1O | 10.1039/C3MD00364G | |||
| 168283120 | 191059 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -60255 | 4 | ChEMBL | 498 | 8 | 4 | 11 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(OC)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5187330 | 191059 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -60255 | 4 | ChEMBL | 498 | 8 | 4 | 11 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(OC)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 168287894 | 191349 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -776 | 4 | ChEMBL | 502 | 7 | 4 | 10 | 1.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccc(Cl)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5191989 | 191349 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | -776 | 4 | ChEMBL | 502 | 7 | 4 | 10 | 1.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccc(Cl)cc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 71657835 | 159735 | None | 3 | Human | Functional | pEC50 | = | 4.1 | 4.1 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL4104819 | 159735 | None | 3 | Human | Functional | pEC50 | = | 4.1 | 4.1 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 16103176 | 83221 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 417 | 6 | 5 | 11 | -1.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccco4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| CHEMBL218596 | 83221 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 417 | 6 | 5 | 11 | -1.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NNC(=O)c4ccco4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm061170a | |||
| 118732982 | 118521 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -91 | 4 | ChEMBL | 583 | 6 | 3 | 12 | 1.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccccc5I)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| CHEMBL3414948 | 118521 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -91 | 4 | ChEMBL | 583 | 6 | 3 | 12 | 1.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(NCc5ccccc5I)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/acs.jmedchem.5b00074 | |||
| 145976032 | 163585 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 402 | 7 | 2 | 7 | 3.9 | N#Cc1c(N)nc(SCc2ccn[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4203420 | 163585 | None | 0 | Human | Functional | pEC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 402 | 7 | 2 | 7 | 3.9 | N#Cc1c(N)nc(SCc2ccn[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 155535452 | 172088 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -14 | 2 | ChEMBL | 286 | 4 | 2 | 7 | 1.8 | N#Cc1c(N)nc(SCCO)c(C#N)c1-c1ccoc1 | 10.1021/acs.jmedchem.9b00106 | |||
| CHEMBL4472401 | 172088 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -14 | 2 | ChEMBL | 286 | 4 | 2 | 7 | 1.8 | N#Cc1c(N)nc(SCCO)c(C#N)c1-c1ccoc1 | 10.1021/acs.jmedchem.9b00106 | |||
| 118734374 | 118633 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -22 | 2 | ChEMBL | 642 | 8 | 4 | 12 | 2.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(N4CCN(c5ccc(OCc6ccc(C(F)(F)F)cc6)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| CHEMBL3416808 | 118633 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -22 | 2 | ChEMBL | 642 | 8 | 4 | 12 | 2.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(N4CCN(c5ccc(OCc6ccc(C(F)(F)F)cc6)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| 69961639 | 175730 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -8 | 2 | ChEMBL | 302 | 4 | 2 | 7 | 2.2 | N#Cc1c(N)nc(SCCO)c(C#N)c1-c1cccs1 | 10.1021/acs.jmedchem.9b00106 | |||
| CHEMBL4582726 | 175730 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | -8 | 2 | ChEMBL | 302 | 4 | 2 | 7 | 2.2 | N#Cc1c(N)nc(SCCO)c(C#N)c1-c1cccs1 | 10.1021/acs.jmedchem.9b00106 | |||
| 46865897 | 7795 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 413 | 5 | 2 | 8 | 4.2 | O=C(Nc1ccccc1)Nc1nc(Oc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2010.02.039 | |||
| CHEMBL1089440 | 7795 | None | 0 | Human | Functional | pEC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 413 | 5 | 2 | 8 | 4.2 | O=C(Nc1ccccc1)Nc1nc(Oc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2010.02.039 | |||
| 16202841 | 84674 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 442 | 6 | 6 | 11 | -0.2 | Nc1nc(OCCc2c[nH]c3ccc(O)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| CHEMBL222500 | 84674 | None | 0 | Human | Functional | pEC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 442 | 6 | 6 | 11 | -0.2 | Nc1nc(OCCc2c[nH]c3ccc(O)cc23)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm061278q | |||
| 11164346 | 16134 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 362 | 5 | 2 | 7 | 3.1 | COc1ccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)cc1 | 10.1021/jm049947s | |||
| CHEMBL122396 | 16134 | None | 0 | Human | Functional | pEC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 362 | 5 | 2 | 7 | 3.1 | COc1ccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)cc1 | 10.1021/jm049947s | |||
| 145973077 | 164675 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 402 | 7 | 2 | 7 | 3.9 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4216880 | 164675 | None | 0 | Human | Functional | pEC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 402 | 7 | 2 | 7 | 3.9 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(OCC2CC2)cc1 | 10.1016/j.ejmech.2018.02.081 | |||
| 137641858 | 158305 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | 1 | 4 | ChEMBL | 696 | 13 | 5 | 11 | 5.3 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccc(-c2sccc2-c2cccc(C(F)(F)F)c2)cc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4089092 | 158305 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | 1 | 4 | ChEMBL | 696 | 13 | 5 | 11 | 5.3 | O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccc(-c2sccc2-c2cccc(C(F)(F)F)c2)cc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 168269866 | 189986 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -3090 | 4 | ChEMBL | 468 | 7 | 4 | 10 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5171042 | 189986 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -3090 | 4 | ChEMBL | 468 | 7 | 4 | 10 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 118734372 | 118631 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -17 | 2 | ChEMBL | 608 | 8 | 4 | 12 | 1.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(N4CCN(c5ccc(OCc6ccc(Cl)cc6)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| CHEMBL3416806 | 118631 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -17 | 2 | ChEMBL | 608 | 8 | 4 | 12 | 1.7 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(N4CCN(c5ccc(OCc6ccc(Cl)cc6)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| 118734345 | 118607 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -301 | 2 | ChEMBL | 545 | 8 | 5 | 12 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCN4CCN(c5ccc(Cl)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| CHEMBL3416780 | 118607 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -301 | 2 | ChEMBL | 545 | 8 | 5 | 12 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCN4CCN(c5ccc(Cl)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| 118734346 | 118608 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -218 | 2 | ChEMBL | 589 | 8 | 5 | 12 | 0.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCN4CCN(c5ccc(Br)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| CHEMBL3416781 | 118608 | None | 0 | Human | Functional | pEC50 | = | 5.0 | 5.0 | -218 | 2 | ChEMBL | 589 | 8 | 5 | 12 | 0.2 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCN4CCN(c5ccc(Br)cc5)CC4)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00215 | |||
| 89534951 | 164429 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 393 | 7 | 2 | 7 | 2.7 | CNC(=O)CSc1nc(N)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N | 10.1016/j.ejmech.2018.02.081 | |||
| CHEMBL4213681 | 164429 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 393 | 7 | 2 | 7 | 2.7 | CNC(=O)CSc1nc(N)c(C#N)c(-c2ccc(OCC3CC3)cc2)c1C#N | 10.1016/j.ejmech.2018.02.081 | |||
| 377 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acsmedchemlett.0c00509 | |||
| 425 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acsmedchemlett.0c00509 | |||
| 448222 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acsmedchemlett.0c00509 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -48 | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acsmedchemlett.0c00509 | |||
| 168272212 | 190429 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -2 | 4 | ChEMBL | 518 | 10 | 5 | 10 | 1.9 | O=C(NCCCCc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| CHEMBL5178142 | 190429 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -2 | 4 | ChEMBL | 518 | 10 | 5 | 10 | 1.9 | O=C(NCCCCc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)c1ccccc1 | 10.1021/acs.jmedchem.2c00320 | |||
| 71657835 | 159735 | None | 3 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4104819 | 159735 | None | 3 | Human | Functional | pEC50 | = | 7.0 | 7.0 | -1 | 4 | ChEMBL | 815 | 15 | 6 | 13 | 6.1 | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 | 10.1021/acs.jmedchem.8b00047 | |||
| 9869857 | 66828 | None | 11 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL186113 | 66828 | None | 11 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -213 | 5 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 24827290 | 156353 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 707 | 11 | 5 | 12 | 3.0 | O=C(COc1ccc(Nc2nc(OCCc3c[nH]c4cc(Br)ccc34)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)N1CCCC1 | 10.1021/jm701442d | |||
| CHEMBL406594 | 156353 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 707 | 11 | 5 | 12 | 3.0 | O=C(COc1ccc(Nc2nc(OCCc3c[nH]c4cc(Br)ccc34)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1)N1CCCC1 | 10.1021/jm701442d | |||
| 137634052 | 156643 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | 6 | 3 | ChEMBL | 830 | 15 | 7 | 14 | 5.7 | Nc1nc(NCCCCCCNC(=O)c2ccc(-c3sc(N)c(C(=O)c4ccccc4)c3-c3cccc(C(F)(F)F)c3)cc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/acs.jmedchem.8b00047 | |||
| CHEMBL4069296 | 156643 | None | 0 | Human | Functional | pEC50 | = | 7.0 | 7.0 | 6 | 3 | ChEMBL | 830 | 15 | 7 | 14 | 5.7 | Nc1nc(NCCCCCCNC(=O)c2ccc(-c3sc(N)c(C(=O)c4ccccc4)c3-c3cccc(C(F)(F)F)c3)cc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/acs.jmedchem.8b00047 | |||
| 168276883 | 190198 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -1862 | 4 | ChEMBL | 502 | 7 | 4 | 10 | 1.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| CHEMBL5174429 | 190198 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -1862 | 4 | ChEMBL | 502 | 7 | 4 | 10 | 1.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@H]4Oc4cccc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.2c01414 | |||
| 155541051 | 172964 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -251 | 2 | ChEMBL | 406 | 5 | 1 | 8 | 4.2 | COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3cccs3)c2C#N)c1 | 10.1021/acs.jmedchem.9b00106 | |||
| CHEMBL4517597 | 172964 | None | 0 | Human | Functional | pEC50 | = | 6.0 | 6.0 | -251 | 2 | ChEMBL | 406 | 5 | 1 | 8 | 4.2 | COC(=O)c1cccc(CSc2nc(N)c(C#N)c(-c3cccs3)c2C#N)c1 | 10.1021/acs.jmedchem.9b00106 | |||
| 16203669 | 85003 | None | 0 | Human | Functional | pEC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 467 | 7 | 5 | 10 | 0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(OCCc4c[nH]c5ccccc45)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061278q | |||
| CHEMBL223845 | 85003 | None | 0 | Human | Functional | pEC50 | = | 6 | 6.0 | - | 1 | ChEMBL | 467 | 7 | 5 | 10 | 0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(OCCc4c[nH]c5ccccc45)nc32)[C@H](O)[C@@H]1O | 10.1021/jm061278q | |||
| 156018418 | 177791 | None | 0 | Human | Functional | pIC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 500 | 7 | 3 | 11 | 1.8 | Nc1nc(NCCN2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4643397 | 177791 | None | 0 | Human | Functional | pIC50 | = | 9.5 | 9.5 | - | 1 | ChEMBL | 500 | 7 | 3 | 11 | 1.8 | Nc1nc(NCCN2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 3284 | 3214 | None | 35 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 44185871 | 3214 | None | 35 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 5728 | 3214 | None | 35 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Functional | pIC50 | = | 9.0 | 9.0 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 12066874 | 204251 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 262 | 1 | 1 | 5 | 2.7 | Oc1c(-c2ccccc2)nnc2nc3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL7113 | 204251 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | - | 1 | ChEMBL | 262 | 1 | 1 | 5 | 2.7 | Oc1c(-c2ccccc2)nnc2nc3ccccc3n12 | 10.1021/jm201177b | |||
| 25207803 | 5683 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | 10 | 4 | ChEMBL | 381 | 6 | 2 | 8 | 4.0 | CNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| CHEMBL1077943 | 5683 | None | 0 | Human | Functional | pIC50 | = | 8.9 | 8.9 | 10 | 4 | ChEMBL | 381 | 6 | 2 | 8 | 4.0 | CNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| 156821415 | 185471 | None | 0 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 5 | 2 | ChEMBL | 398 | 4 | 1 | 8 | 3.0 | Nc1nc(-c2ccccc2)c(-c2ccnnc2)c2nc(Cc3ncccc3F)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4862010 | 185471 | None | 0 | Human | Functional | pIC50 | = | 8.8 | 8.8 | 5 | 2 | ChEMBL | 398 | 4 | 1 | 8 | 3.0 | Nc1nc(-c2ccccc2)c(-c2ccnnc2)c2nc(Cc3ncccc3F)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| 44186667 | 185657 | None | 0 | Human | Functional | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486479 | 185657 | None | 0 | Human | Functional | pIC50 | = | 8.8 | 8.8 | - | 1 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186622 | 184227 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL483469 | 184227 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 10641040 | 9763 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 342 | 3 | 0 | 6 | 3.4 | O=c1c(-c2ccco2)nnc2n(Cc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL113518 | 9763 | None | 0 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 342 | 3 | 0 | 6 | 3.4 | O=c1c(-c2ccco2)nnc2n(Cc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 11605883 | 79950 | None | 6 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL212625 | 79950 | None | 6 | Human | Functional | pIC50 | = | 8 | 8.0 | - | 1 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44185933 | 186707 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 522 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL488541 | 186707 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 522 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 135493268 | 110484 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32481 | 110484 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 134142435 | 145336 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 341 | 4 | 2 | 7 | 3.7 | Nc1nc(NCc2cccc(F)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3913413 | 145336 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 341 | 4 | 2 | 7 | 3.7 | Nc1nc(NCc2cccc(F)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 45481749 | 198532 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 437 | 5 | 1 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Cc3ccc4ccccc4c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL578008 | 198532 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 437 | 5 | 1 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Cc3ccc4ccccc4c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 60156108 | 76984 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -69 | 2 | ChEMBL | 532 | 5 | 3 | 9 | 2.9 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCc4ccc(F)cc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2071046 | 76984 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -69 | 2 | ChEMBL | 532 | 5 | 3 | 9 | 2.9 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCc4ccc(F)cc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 135874429 | 95753 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258473 | 95753 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 57429602 | 157237 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4076435 | 157237 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| 51039214 | 71521 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 342 | 5 | 3 | 9 | 1.5 | NCC1CCC(CNc2nc(N)n3nc(-c4ccco4)nc3n2)CC1 | 10.1021/jm101349u | |||
| CHEMBL1927444 | 71521 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 342 | 5 | 3 | 9 | 1.5 | NCC1CCC(CNc2nc(N)n3nc(-c4ccco4)nc3n2)CC1 | 10.1021/jm101349u | |||
| CHEMBL1962813 | 71521 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 342 | 5 | 3 | 9 | 1.5 | NCC1CCC(CNc2nc(N)n3nc(-c4ccco4)nc3n2)CC1 | 10.1021/jm101349u | |||
| 135522388 | 100110 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL287529 | 100110 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 46883206 | 6315 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 10 | 2 | ChEMBL | 347 | 5 | 1 | 7 | 3.3 | O=C(c1cccnc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1081873 | 6315 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 10 | 2 | ChEMBL | 347 | 5 | 1 | 7 | 3.3 | O=C(c1cccnc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 145436767 | 162476 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4365 | 2 | ChEMBL | 324 | 4 | 2 | 8 | 2.9 | Nc1nc(NCc2cccnc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4167125 | 162476 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -4365 | 2 | ChEMBL | 324 | 4 | 2 | 8 | 2.9 | Nc1nc(NCc2cccnc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 136042340 | 71164 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 527 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955916 | 71164 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | - | 1 | ChEMBL | 527 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 10007115 | 116342 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL335950 | 116342 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 52947525 | 17657 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -389 | 3 | ChEMBL | 451 | 6 | 2 | 7 | 5.2 | COc1ccc(Nc2c(-c3ccc4nccnc4c3)c(C)nn2-c2ccccc2)c(C(=O)O)c1 | 10.1016/j.bmcl.2010.07.095 | |||
| CHEMBL1258397 | 17657 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -389 | 3 | ChEMBL | 451 | 6 | 2 | 7 | 5.2 | COc1ccc(Nc2c(-c3ccc4nccnc4c3)c(C)nn2-c2ccccc2)c(C(=O)O)c1 | 10.1016/j.bmcl.2010.07.095 | |||
| 1922 | 202816 | None | 44 | Rat | Functional | pIC50 | = | 6.0 | 6.0 | -363 | 9 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm990499b | |||
| CHEMBL62350 | 202816 | None | 44 | Rat | Functional | pIC50 | = | 6.0 | 6.0 | -363 | 9 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm990499b | |||
| 145960667 | 161480 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 285 | 4 | 2 | 6 | 2.6 | Cc1nc2c(N)nc(NCCc3ccccc3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4127811 | 161480 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 285 | 4 | 2 | 6 | 2.6 | Cc1nc2c(N)nc(NCCc3ccccc3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| 60156105 | 76982 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 2 | ChEMBL | 514 | 5 | 3 | 9 | 2.8 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2071044 | 76982 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 2 | ChEMBL | 514 | 5 | 3 | 9 | 2.8 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 45481761 | 198003 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 539 | 8 | 1 | 8 | 5.8 | O=C(Cc1ccc(-c2ccccc2)cc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL573771 | 198003 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 539 | 8 | 1 | 8 | 5.8 | O=C(Cc1ccc(-c2ccccc2)cc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2009.05.038 | |||
| 51051249 | 69285 | None | 1 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 217 | 1 | 2 | 8 | -0.1 | Nc1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1021/jm101349u | |||
| CHEMBL1927632 | 69285 | None | 1 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 217 | 1 | 2 | 8 | -0.1 | Nc1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1021/jm101349u | |||
| 127046494 | 139743 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 307 | 3 | 2 | 7 | 2.4 | Nc1nc(-c2ccco2)nc2cn(Cc3ccccc3O)nc12 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3798383 | 139743 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 307 | 3 | 2 | 7 | 2.4 | Nc1nc(-c2ccco2)nc2cn(Cc3ccccc3O)nc12 | 10.1016/j.bmc.2016.04.048 | |||
| 145436765 | 162793 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -2511 | 2 | ChEMBL | 343 | 5 | 2 | 8 | 3.6 | Nc1nc(NCCc2cccs2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4172264 | 162793 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -2511 | 2 | ChEMBL | 343 | 5 | 2 | 8 | 3.6 | Nc1nc(NCCc2cccs2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 136042342 | 71166 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 479 | 9 | 2 | 10 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955918 | 71166 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 479 | 9 | 2 | 10 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135874414 | 96253 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 575 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(I)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261027 | 96253 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 575 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(I)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 135443359 | 490 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 441 | 490 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL431703 | 490 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 127036844 | 137556 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 397 | 7 | 2 | 8 | 4.0 | c1ccc(CNc2nc(NCc3ccccc3)n3nc(-c4ccco4)nc3n2)cc1 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL3754573 | 137556 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 397 | 7 | 2 | 8 | 4.0 | c1ccc(CNc2nc(NCc3ccccc3)n3nc(-c4ccco4)nc3n2)cc1 | 10.1016/j.ejmech.2015.12.019 | |||
| 49797906 | 10742 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 467 | 7 | 1 | 7 | 4.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171165 | 10742 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 467 | 7 | 1 | 7 | 4.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 9930130 | 10799 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 387 | 5 | 1 | 5 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171897 | 10799 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 387 | 5 | 1 | 5 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 25231167 | 6215 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 20 | 2 | ChEMBL | 313 | 5 | 2 | 6 | 2.4 | CCNC(=O)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1081335 | 6215 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 20 | 2 | ChEMBL | 313 | 5 | 2 | 6 | 2.4 | CCNC(=O)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 16071896 | 58023 | None | 44 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 4 | 2 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672627 | 58023 | None | 44 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 4 | 2 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 71508481 | 86274 | None | 6 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 250 | 1 | 1 | 5 | 2.7 | Nc1nc2ccccc2c2cc(-c3ccco3)nn12 | 10.1016/j.bmc.2012.10.031 | |||
| CHEMBL2312725 | 86274 | None | 6 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 250 | 1 | 1 | 5 | 2.7 | Nc1nc2ccccc2c2cc(-c3ccco3)nn12 | 10.1016/j.bmc.2012.10.031 | |||
| 135529386 | 489 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| 440 | 489 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| CHEMBL284615 | 489 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| 135546657 | 157696 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL408186 | 157696 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 145954471 | 162380 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 367 | 5 | 2 | 8 | 3.9 | COc1cccc(CNc2nc(N)c3nc(-c4ccc(C)o4)sc3n2)c1 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4165484 | 162380 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 367 | 5 | 2 | 8 | 3.9 | COc1cccc(CNc2nc(N)c3nc(-c4ccc(C)o4)sc3n2)c1 | 10.1016/j.ejmech.2018.06.020 | |||
| 11793210 | 185870 | None | 0 | Rat | Functional | pIC50 | = | 5.9 | 5.9 | -7 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccc(F)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL48681 | 185870 | None | 0 | Rat | Functional | pIC50 | = | 5.9 | 5.9 | -7 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccc(F)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 57395163 | 69787 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3cnn(C)c3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935756 | 69787 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3cnn(C)c3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| 45482090 | 197954 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 463 | 7 | 1 | 8 | 4.6 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL573327 | 197954 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 463 | 7 | 1 | 8 | 4.6 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 118708225 | 113356 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 319 | 3 | 1 | 5 | 3.1 | Nc1nc(Cc2ccccc2F)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317565 | 113356 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 319 | 3 | 1 | 5 | 3.1 | Nc1nc(Cc2ccccc2F)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 45482075 | 198301 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 451 | 6 | 1 | 8 | 4.5 | CCCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL576018 | 198301 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 451 | 6 | 1 | 8 | 4.5 | CCCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46882998 | 5639 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -10 | 2 | ChEMBL | 303 | 4 | 1 | 6 | 3.7 | CCNc1nc(C(=O)c2ccc(C)s2)c2sccc2n1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077752 | 5639 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -10 | 2 | ChEMBL | 303 | 4 | 1 | 6 | 3.7 | CCNc1nc(C(=O)c2ccc(C)s2)c2sccc2n1 | 10.1016/j.bmcl.2009.08.040 | |||
| 164627235 | 186411 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -22 | 2 | ChEMBL | 433 | 4 | 2 | 7 | 3.2 | Cc1cc(-c2c(-c3ccc(F)cc3)nc(N)n3nc(CN4CCCCC4)nc23)c[nH]c1=O | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4876056 | 186411 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -22 | 2 | ChEMBL | 433 | 4 | 2 | 7 | 3.2 | Cc1cc(-c2c(-c3ccc(F)cc3)nc(N)n3nc(CN4CCCCC4)nc23)c[nH]c1=O | 10.1021/acsmedchemlett.1c00620 | |||
| 135493281 | 109624 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(Cl)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32225 | 109624 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(Cl)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 46883205 | 5848 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -2 | 2 | ChEMBL | 376 | 6 | 1 | 7 | 3.9 | COc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)cc1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079232 | 5848 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -2 | 2 | ChEMBL | 376 | 6 | 1 | 7 | 3.9 | COc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)cc1 | 10.1016/j.bmcl.2009.08.040 | |||
| 155554091 | 175689 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -4 | 3 | ChEMBL | 375 | 5 | 2 | 7 | 3.1 | N#Cc1c(N)nc(SCc2cccc(C(N)=O)c2)c(C#N)c1-c1ccco1 | 10.1021/acs.jmedchem.9b00106 | |||
| CHEMBL4581984 | 175689 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -4 | 3 | ChEMBL | 375 | 5 | 2 | 7 | 3.1 | N#Cc1c(N)nc(SCc2cccc(C(N)=O)c2)c(C#N)c1-c1ccco1 | 10.1021/acs.jmedchem.9b00106 | |||
| 49798140 | 10868 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 484 | 9 | 1 | 7 | 3.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N(C)CCOC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172442 | 10868 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 484 | 9 | 1 | 7 | 3.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N(C)CCOC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 25231166 | 6351 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 181 | 2 | ChEMBL | 353 | 4 | 1 | 6 | 3.5 | CC(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1082064 | 6351 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 181 | 2 | ChEMBL | 353 | 4 | 1 | 6 | 3.5 | CC(Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 | 10.1016/j.bmcl.2009.08.040 | |||
| 54581142 | 60730 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 598 | 8 | 2 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NS(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760896 | 60730 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 598 | 8 | 2 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NS(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 145436761 | 162835 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -1 | 2 | ChEMBL | 325 | 4 | 2 | 9 | 2.3 | Nc1nc(NCc2cnccn2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4172818 | 162835 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -1 | 2 | ChEMBL | 325 | 4 | 2 | 9 | 2.3 | Nc1nc(NCc2cnccn2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 11826924 | 118743 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 479 | 8 | 1 | 9 | 4.0 | O=C(COc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL341777 | 118743 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 479 | 8 | 1 | 9 | 4.0 | O=C(COc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 10665407 | 190746 | None | 0 | Rat | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 348 | 1 | 2 | 7 | 2.1 | Cn1c(-c2ccccn2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL51829 | 190746 | None | 0 | Rat | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 348 | 1 | 2 | 7 | 2.1 | Cn1c(-c2ccccn2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 45482076 | 198100 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 391 | 4 | 1 | 8 | 2.6 | Cn1cc2c(nc(NC(=O)Cc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL574483 | 198100 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 391 | 4 | 1 | 8 | 2.6 | Cn1cc2c(nc(NC(=O)Cc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46238067 | 8504 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -229 | 2 | ChEMBL | 420 | 5 | 2 | 5 | 5.2 | O=C(Nc1ccccc1)Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12 | 10.1021/jm901785w | |||
| CHEMBL1094132 | 8504 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -229 | 2 | ChEMBL | 420 | 5 | 2 | 5 | 5.2 | O=C(Nc1ccccc1)Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12 | 10.1021/jm901785w | |||
| 46238066 | 8503 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -173 | 2 | ChEMBL | 439 | 5 | 1 | 5 | 5.4 | O=C(Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12)c1cccc(Cl)c1 | 10.1021/jm901785w | |||
| CHEMBL1094131 | 8503 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | -173 | 2 | ChEMBL | 439 | 5 | 1 | 5 | 5.4 | O=C(Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12)c1cccc(Cl)c1 | 10.1021/jm901785w | |||
| 145962529 | 161389 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 291 | 4 | 2 | 7 | 2.7 | Cc1nc2c(N)nc(NCCc3cccs3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4126427 | 161389 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 291 | 4 | 2 | 7 | 2.7 | Cc1nc2c(N)nc(NCCc3cccs3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| 15729970 | 137296 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 299 | 3 | 2 | 8 | 2.1 | Nc1nc(NC2CCCCC2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL3752431 | 137296 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 299 | 3 | 2 | 8 | 2.1 | Nc1nc(NC2CCCCC2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| 145964662 | 164436 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 433 | 8 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4213768 | 164436 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 433 | 8 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 45481758 | 198344 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 379 | 4 | 1 | 9 | 2.5 | Cn1cc2c(nc(NC(=O)Cc3ccsc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL576369 | 198344 | None | 0 | Human | Functional | pIC50 | = | 4.9 | 4.9 | - | 1 | ChEMBL | 379 | 4 | 1 | 9 | 2.5 | Cn1cc2c(nc(NC(=O)Cc3ccsc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 45481619 | 198325 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 463 | 7 | 1 | 8 | 4.6 | CC(C)CCn1cc2c(nc(NC(=O)Cc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL576185 | 198325 | None | 0 | Human | Functional | pIC50 | = | 5.9 | 5.9 | - | 1 | ChEMBL | 463 | 7 | 1 | 8 | 4.6 | CC(C)CCn1cc2c(nc(NC(=O)Cc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 53248698 | 60721 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 534 | 6 | 1 | 6 | 4.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760886 | 60721 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | - | 1 | ChEMBL | 534 | 6 | 1 | 6 | 4.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10544916 | 188307 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 15 | 2 | ChEMBL | 337 | 1 | 2 | 7 | 2.3 | Cn1c(-c2ccco2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL50051 | 188307 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | 15 | 2 | ChEMBL | 337 | 1 | 2 | 7 | 2.3 | Cn1c(-c2ccco2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 145436762 | 162508 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -3 | 2 | ChEMBL | 327 | 5 | 2 | 8 | 3.2 | Nc1nc(NCCc2ccco2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4167557 | 162508 | None | 0 | Human | Functional | pIC50 | = | 7.9 | 7.9 | -3 | 2 | ChEMBL | 327 | 5 | 2 | 8 | 3.2 | Nc1nc(NCCc2ccco2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 11027412 | 29627 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 493 | 9 | 1 | 9 | 4.4 | O=C(COc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL138593 | 29627 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 493 | 9 | 1 | 9 | 4.4 | O=C(COc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 135465785 | 488 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 439 | 488 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL32582 | 488 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 10665761 | 189274 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 3 | 2 | ChEMBL | 353 | 3 | 2 | 6 | 2.7 | CCC(O)(C#Cc1nc(N)c2nc(-c3cccc(F)c3)n(C)c2n1)CC | 10.1021/jm990499b | |||
| CHEMBL51192 | 189274 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | 3 | 2 | ChEMBL | 353 | 3 | 2 | 6 | 2.7 | CCC(O)(C#Cc1nc(N)c2nc(-c3cccc(F)c3)n(C)c2n1)CC | 10.1021/jm990499b | |||
| 145976828 | 163676 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 447 | 9 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4204683 | 163676 | None | 0 | Human | Functional | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 447 | 9 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 45482081 | 197927 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 497 | 7 | 1 | 8 | 5.3 | CC(C)CCn1cc2c(nc(NC(=O)Cc3c(Cl)cccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL573089 | 197927 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 497 | 7 | 1 | 8 | 5.3 | CC(C)CCn1cc2c(nc(NC(=O)Cc3c(Cl)cccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 156010667 | 177115 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 556 | 9 | 4 | 11 | 2.0 | Nc1nc(NCC2CCN(CC(=O)NCc3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4633630 | 177115 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 556 | 9 | 4 | 11 | 2.0 | Nc1nc(NCC2CCN(CC(=O)NCc3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 46238068 | 8733 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -181 | 2 | ChEMBL | 450 | 6 | 2 | 6 | 5.2 | COc1ccc(NC(=O)Nc2nc(-c3ccccc3)nc3nn(Cc4ccccc4)cc23)cc1 | 10.1021/jm901785w | |||
| CHEMBL1096078 | 8733 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -181 | 2 | ChEMBL | 450 | 6 | 2 | 6 | 5.2 | COc1ccc(NC(=O)Nc2nc(-c3ccccc3)nc3nn(Cc4ccccc4)cc23)cc1 | 10.1021/jm901785w | |||
| 46883157 | 5820 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 11 | 2 | ChEMBL | 353 | 5 | 1 | 8 | 3.4 | O=C(c1cncs1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079044 | 5820 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 11 | 2 | ChEMBL | 353 | 5 | 1 | 8 | 3.4 | O=C(c1cncs1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 46883155 | 5835 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 352 | 5 | 1 | 7 | 4.0 | O=C(c1ccsc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079132 | 5835 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 352 | 5 | 1 | 7 | 4.0 | O=C(c1ccsc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 10449783 | 9644 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 338 | 2 | 0 | 5 | 3.7 | O=c1c(-c2ccccc2)nnc2n(-c3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL112756 | 9644 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 338 | 2 | 0 | 5 | 3.7 | O=c1c(-c2ccccc2)nnc2n(-c3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 10237267 | 10800 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 373 | 4 | 1 | 5 | 3.7 | COc1ccc(N(C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171898 | 10800 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 373 | 4 | 1 | 5 | 3.7 | COc1ccc(N(C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 136042350 | 71148 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 496 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955899 | 71148 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 496 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 10824674 | 204906 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 252 | 1 | 1 | 6 | 2.2 | Oc1c(-c2ccco2)nnc2nc3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL7608 | 204906 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 252 | 1 | 1 | 6 | 2.2 | Oc1c(-c2ccco2)nnc2nc3ccccc3n12 | 10.1021/jm201177b | |||
| 10895565 | 168450 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 445 | 8 | 1 | 9 | 3.8 | CC(C)CCn1cc2c(nc(NC(=O)COc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL435022 | 168450 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 445 | 8 | 1 | 9 | 3.8 | CC(C)CCn1cc2c(nc(NC(=O)COc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 10616023 | 101860 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 3 | 2 | ChEMBL | 325 | 1 | 2 | 6 | 1.9 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC(C)(C)O)nc21 | 10.1021/jm990499b | |||
| CHEMBL300624 | 101860 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 3 | 2 | ChEMBL | 325 | 1 | 2 | 6 | 1.9 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC(C)(C)O)nc21 | 10.1021/jm990499b | |||
| 6448585 | 98337 | None | 6 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 412 | 8 | 0 | 8 | 2.9 | CCCn1c(=O)c2c(nc(/C=C/c3ccc(OC)c(OC)c3)n2C)n(CCC)c1=O | 10.1021/jm990499b | |||
| CHEMBL2311150 | 98337 | None | 6 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 412 | 8 | 0 | 8 | 2.9 | CCCn1c(=O)c2c(nc(/C=C/c3ccc(OC)c(OC)c3)n2C)n(CCC)c1=O | 10.1021/jm990499b | |||
| CHEMBL27508 | 98337 | None | 6 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -1513 | 3 | ChEMBL | 412 | 8 | 0 | 8 | 2.9 | CCCn1c(=O)c2c(nc(/C=C/c3ccc(OC)c(OC)c3)n2C)n(CCC)c1=O | 10.1021/jm990499b | |||
| 45481757 | 198005 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 393 | 5 | 1 | 9 | 3.0 | CCn1cc2c(nc(NC(=O)Cc3cccs3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL573779 | 198005 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 393 | 5 | 1 | 9 | 3.0 | CCn1cc2c(nc(NC(=O)Cc3cccs3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 155554464 | 174600 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -30 | 3 | ChEMBL | 362 | 5 | 2 | 7 | 3.5 | N#Cc1c(N)nc(SCc2cccc(CO)c2)c(C#N)c1-c1ccco1 | 10.1021/acs.jmedchem.9b00106 | |||
| CHEMBL4557250 | 174600 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | -30 | 3 | ChEMBL | 362 | 5 | 2 | 7 | 3.5 | N#Cc1c(N)nc(SCc2cccc(CO)c2)c(C#N)c1-c1ccco1 | 10.1021/acs.jmedchem.9b00106 | |||
| 127045701 | 139968 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 3.7 | Cc1ccc(-c2nc(N)c3nn(Cc4ccccc4Cl)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3799848 | 139968 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 3.7 | Cc1ccc(-c2nc(N)c3nn(Cc4ccccc4Cl)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| 136002186 | 109699 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32281 | 109699 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 23656936 | 154894 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -2630 | 2 | ChEMBL | 425 | 4 | 1 | 7 | 3.6 | COc1ccc(C(=O)Nc2nc3ccccc3n3c(=O)c(-c4ccc(C)cc4)nn23)cc1 | 10.1021/jm0708376 | |||
| CHEMBL400812 | 154894 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -2630 | 2 | ChEMBL | 425 | 4 | 1 | 7 | 3.6 | COc1ccc(C(=O)Nc2nc3ccccc3n3c(=O)c(-c4ccc(C)cc4)nn23)cc1 | 10.1021/jm0708376 | |||
| 60156107 | 76983 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -33 | 2 | ChEMBL | 542 | 7 | 3 | 9 | 3.2 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCCCc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2071045 | 76983 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -33 | 2 | ChEMBL | 542 | 7 | 3 | 9 | 3.2 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCCCc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 135874415 | 95892 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 527 | 8 | 2 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Br)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL259177 | 95892 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 527 | 8 | 2 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Br)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 156018055 | 177918 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 570 | 10 | 4 | 11 | 2.1 | Nc1nc(NCC2CCN(CC(=O)NCCc3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4645283 | 177918 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 570 | 10 | 4 | 11 | 2.1 | Nc1nc(NCC2CCN(CC(=O)NCCc3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 49797748 | 10618 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 480 | 6 | 1 | 6 | 4.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCCCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170135 | 10618 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 480 | 6 | 1 | 6 | 4.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCCCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49798137 | 10743 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 466 | 6 | 1 | 6 | 4.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171200 | 10743 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 466 | 6 | 1 | 6 | 4.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 46883208 | 5978 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 3 | 2 | ChEMBL | 386 | 5 | 1 | 7 | 4.6 | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2cc(Cl)sc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1080068 | 5978 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 3 | 2 | ChEMBL | 386 | 5 | 1 | 7 | 4.6 | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2cc(Cl)sc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 54581142 | 60719 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 598 | 8 | 2 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](NS(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760884 | 60719 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 598 | 8 | 2 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](NS(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 44186717 | 184143 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL482855 | 184143 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 135465774 | 111477 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32770 | 111477 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11793210 | 185870 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 7 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccc(F)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL48681 | 185870 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 7 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccc(F)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 10667322 | 101499 | None | 0 | Rat | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 377 | 2 | 2 | 7 | 2.7 | COc1cccc(-c2nc3c(N)nc(C#CC4(O)CCCCC4)nc3n2C)c1 | 10.1021/jm990499b | |||
| CHEMBL297949 | 101499 | None | 0 | Rat | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 377 | 2 | 2 | 7 | 2.7 | COc1cccc(-c2nc3c(N)nc(C#CC4(O)CCCCC4)nc3n2C)c1 | 10.1021/jm990499b | |||
| 46883107 | 5830 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 5 | 2 | ChEMBL | 380 | 5 | 1 | 7 | 4.9 | Cc1ccc(C(=O)c2nc(NC(C)c3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079115 | 5830 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 5 | 2 | ChEMBL | 380 | 5 | 1 | 7 | 4.9 | Cc1ccc(C(=O)c2nc(NC(C)c3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 54584124 | 60726 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 548 | 6 | 1 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(C(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760892 | 60726 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 548 | 6 | 1 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(C(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10906943 | 116528 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 479 | 7 | 1 | 8 | 5.1 | CC(C)CCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL336217 | 116528 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 479 | 7 | 1 | 8 | 5.1 | CC(C)CCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 155520955 | 170568 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 351 | 2 | 4 | 9 | 1.2 | Nc1nc(-c2cc(O)c(O)c(O)c2)cn2c(=O)n(-c3ccccc3)nc12 | 10.1021/acs.jmedchem.9b00778 | |||
| CHEMBL4450312 | 170568 | None | 0 | Human | Functional | pIC50 | = | 4.8 | 4.8 | - | 1 | ChEMBL | 351 | 2 | 4 | 9 | 1.2 | Nc1nc(-c2cc(O)c(O)c(O)c2)cn2c(=O)n(-c3ccccc3)nc12 | 10.1021/acs.jmedchem.9b00778 | |||
| 145964230 | 164009 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 461 | 10 | 3 | 6 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4208432 | 164009 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 461 | 10 | 3 | 6 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 60156106 | 76801 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -75 | 2 | ChEMBL | 528 | 6 | 3 | 9 | 2.8 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCCc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2069325 | 76801 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | -75 | 2 | ChEMBL | 528 | 6 | 3 | 9 | 2.8 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCCc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 46883156 | 5819 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 4 | 2 | ChEMBL | 353 | 5 | 1 | 8 | 3.4 | O=C(c1nccs1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079043 | 5819 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | 4 | 2 | ChEMBL | 353 | 5 | 1 | 8 | 3.4 | O=C(c1nccs1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 134147994 | 150108 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 351 | 6 | 2 | 7 | 4.0 | Nc1nc(NCCCc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3951103 | 150108 | None | 0 | Human | Functional | pIC50 | = | 5.8 | 5.8 | - | 1 | ChEMBL | 351 | 6 | 2 | 7 | 4.0 | Nc1nc(NCCCc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 46883110 | 5833 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 352 | 5 | 1 | 7 | 4.0 | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079118 | 5833 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 352 | 5 | 1 | 7 | 4.0 | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 25230181 | 5957 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 26 | 2 | ChEMBL | 353 | 4 | 1 | 6 | 3.5 | C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079894 | 5957 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | 26 | 2 | ChEMBL | 353 | 4 | 1 | 6 | 3.5 | C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 | 10.1016/j.bmcl.2009.08.040 | |||
| 54585058 | 60733 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 520 | 5 | 1 | 5 | 6.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760900 | 60733 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 520 | 5 | 1 | 5 | 6.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 134152846 | 153540 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 369 | 5 | 4 | 9 | 3.0 | Nc1nc(NCCc2ccc(O)c(O)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3980049 | 153540 | None | 0 | Human | Functional | pIC50 | = | 7.8 | 7.8 | - | 1 | ChEMBL | 369 | 5 | 4 | 9 | 3.0 | Nc1nc(NCCc2ccc(O)c(O)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 3284 | 3214 | None | 35 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 44185871 | 3214 | None | 35 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 5728 | 3214 | None | 35 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 136042335 | 71160 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 490 | 8 | 2 | 10 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc(=O)c5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955911 | 71160 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 490 | 8 | 2 | 10 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc(=O)c5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11762982 | 26203 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 513 | 7 | 1 | 8 | 5.3 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL135719 | 26203 | None | 0 | Human | Functional | pIC50 | = | 6.8 | 6.8 | - | 1 | ChEMBL | 513 | 7 | 1 | 8 | 5.3 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 145960536 | 161626 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 271 | 3 | 2 | 6 | 2.6 | Cc1nc2c(N)nc(NCc3ccccc3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4130003 | 161626 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 271 | 3 | 2 | 6 | 2.6 | Cc1nc2c(N)nc(NCc3ccccc3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| 45482085 | 198103 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 421 | 7 | 1 | 9 | 3.8 | CCCCn1cc2c(nc(NC(=O)Cc3cccs3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL574489 | 198103 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 421 | 7 | 1 | 9 | 3.8 | CCCCn1cc2c(nc(NC(=O)Cc3cccs3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 135529391 | 481 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 438 | 481 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL285900 | 481 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 134157761 | 154027 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 289 | 5 | 2 | 7 | 3.1 | CCCCNc1nc(N)c2nc(-c3ccco3)sc2n1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3984266 | 154027 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 289 | 5 | 2 | 7 | 3.1 | CCCCNc1nc(N)c2nc(-c3ccco3)sc2n1 | 10.1021/acs.jmedchem.6b01068 | |||
| 135874430 | 160128 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 517 | 8 | 2 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)c(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL410895 | 160128 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 517 | 8 | 2 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)c(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 25231168 | 5696 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | 32 | 2 | ChEMBL | 339 | 4 | 1 | 6 | 2.9 | O=C(c1nc(NCc2cccnc2)nc2ccsc12)N1CCCC1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078030 | 5696 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | 32 | 2 | ChEMBL | 339 | 4 | 1 | 6 | 2.9 | O=C(c1nc(NCc2cccnc2)nc2ccsc12)N1CCCC1 | 10.1016/j.bmcl.2009.08.040 | |||
| 49797856 | 10849 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 401 | 5 | 1 | 5 | 4.5 | COc1ccc(N(C(C)=O)C(C)C)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172270 | 10849 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 401 | 5 | 1 | 5 | 4.5 | COc1ccc(N(C(C)=O)C(C)C)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797771 | 10853 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4ccnc4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172275 | 10853 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4ccnc4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797773 | 10855 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 490 | 8 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN(C)S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172277 | 10855 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 490 | 8 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN(C)S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 46883106 | 5681 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 6 | 2 | ChEMBL | 380 | 5 | 1 | 7 | 4.9 | Cc1ccc(C(=O)c2nc(NC(C)c3ccccn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077915 | 5681 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 6 | 2 | ChEMBL | 380 | 5 | 1 | 7 | 4.9 | Cc1ccc(C(=O)c2nc(NC(C)c3ccccn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 25230948 | 6033 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 3 | 4 | ChEMBL | 395 | 7 | 2 | 8 | 4.4 | CCNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1080421 | 6033 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | 3 | 4 | ChEMBL | 395 | 7 | 2 | 8 | 4.4 | CCNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 54583134 | 63107 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 534 | 8 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760891 | 63107 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 534 | 8 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1789250 | 63107 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 534 | 8 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 11080491 | 22794 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 429 | 7 | 1 | 8 | 4.0 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL132806 | 22794 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 429 | 7 | 1 | 8 | 4.0 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 10597086 | 208081 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 399 | 6 | 2 | 7 | 3.4 | O=C(O)CCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL97753 | 208081 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 399 | 6 | 2 | 7 | 3.4 | O=C(O)CCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 52948788 | 17728 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | -2137 | 2 | ChEMBL | 489 | 5 | 2 | 6 | 6.3 | Cc1ccccc1-n1nc(C(F)(F)F)c(-c2ccc3nccnc3c2)c1Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.07.095 | |||
| CHEMBL1258622 | 17728 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | -2137 | 2 | ChEMBL | 489 | 5 | 2 | 6 | 6.3 | Cc1ccccc1-n1nc(C(F)(F)F)c(-c2ccc3nccnc3c2)c1Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.07.095 | |||
| 136042345 | 71169 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 585 | 8 | 2 | 9 | 4.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955921 | 71169 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 585 | 8 | 2 | 9 | 4.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 56964460 | 74721 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 362 | 2 | 0 | 6 | 3.9 | O=c1c(-c2ccco2)nnc2n(-c3ccc(Cl)cc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL2030704 | 74721 | None | 0 | Human | Functional | pIC50 | = | 8.7 | 8.7 | - | 1 | ChEMBL | 362 | 2 | 0 | 6 | 3.9 | O=c1c(-c2ccco2)nnc2n(-c3ccc(Cl)cc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 44186668 | 191508 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL519390 | 191508 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 56964459 | 74720 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 372 | 2 | 0 | 5 | 4.4 | O=c1c(-c2ccccc2)nnc2n(-c3ccc(Cl)cc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL2030703 | 74720 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 372 | 2 | 0 | 5 | 4.4 | O=c1c(-c2ccccc2)nnc2n(-c3ccc(Cl)cc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 56964461 | 74722 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 366 | 4 | 0 | 5 | 4.0 | O=c1c(-c2ccccc2)nnc2n(CCc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL2030705 | 74722 | None | 0 | Human | Functional | pIC50 | = | 8.6 | 8.6 | - | 1 | ChEMBL | 366 | 4 | 0 | 5 | 4.0 | O=c1c(-c2ccccc2)nnc2n(CCc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 56924646 | 71170 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 332 | 5 | 2 | 7 | 0.4 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955922 | 71170 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 332 | 5 | 2 | 7 | 0.4 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 53242165 | 60734 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 584 | 6 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760901 | 60734 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 584 | 6 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10539663 | 204230 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 266 | 1 | 0 | 6 | 1.8 | Cn1c2ccccc2n2c(=O)c(-c3ccco3)nnc12 | 10.1021/jm201177b | |||
| CHEMBL7098 | 204230 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 266 | 1 | 0 | 6 | 1.8 | Cn1c2ccccc2n2c(=O)c(-c3ccco3)nnc12 | 10.1021/jm201177b | |||
| 135874421 | 168956 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 477 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)c(C)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL438938 | 168956 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 477 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)c(C)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 51050845 | 69261 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 374 | 6 | 3 | 10 | 1.7 | CC(C)(C)OC(=O)NCCCNc1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1021/jm101349u | |||
| CHEMBL1927428 | 69261 | None | 0 | Human | Functional | pIC50 | = | 4.7 | 4.7 | - | 1 | ChEMBL | 374 | 6 | 3 | 10 | 1.7 | CC(C)(C)OC(=O)NCCCNc1nc(N)n2nc(-c3ccco3)nc2n1 | 10.1021/jm101349u | |||
| 60155796 | 76964 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -16 | 2 | ChEMBL | 471 | 5 | 2 | 9 | 3.1 | Cn1cc2c(nc(NC(=O)NC3CCN(Cc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2070886 | 76964 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -16 | 2 | ChEMBL | 471 | 5 | 2 | 9 | 3.1 | Cn1cc2c(nc(NC(=O)NC3CCN(Cc4ccccc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 145962364 | 161446 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 277 | 3 | 2 | 7 | 2.7 | Cc1nc2c(N)nc(NCc3cccs3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4127395 | 161446 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 277 | 3 | 2 | 7 | 2.7 | Cc1nc2c(N)nc(NCc3cccs3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| 49797747 | 10617 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 482 | 6 | 1 | 7 | 3.4 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCOCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170134 | 10617 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 482 | 6 | 1 | 7 | 3.4 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCOCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797749 | 10619 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cccn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170136 | 10619 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cccn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 46911060 | 10646 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170367 | 10646 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49798138 | 10669 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 426 | 6 | 2 | 6 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)NC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170582 | 10669 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 426 | 6 | 2 | 6 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)NC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797903 | 10739 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 359 | 5 | 2 | 6 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cn[nH]c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171162 | 10739 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 359 | 5 | 2 | 6 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cn[nH]c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 46911060 | 10646 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1170367 | 10646 | None | 0 | Human | Functional | pIC50 | = | 7.7 | 7.7 | - | 1 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10994216 | 194917 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 463 | 7 | 1 | 8 | 4.2 | O=C(Cc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL541455 | 194917 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 463 | 7 | 1 | 8 | 4.2 | O=C(Cc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 1922 | 202816 | None | 44 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -97 | 9 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm990499b | |||
| CHEMBL62350 | 202816 | None | 44 | Human | Functional | pIC50 | = | 6.7 | 6.7 | -97 | 9 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm990499b | |||
| 135874431 | 96254 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 463 | 8 | 2 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261028 | 96254 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 463 | 8 | 2 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 60154739 | 76986 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -177 | 2 | ChEMBL | 528 | 5 | 3 | 9 | 3.1 | Cc1ccc(CNC(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)cc1 | 10.1021/jm300323t | |||
| CHEMBL2071048 | 76986 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -177 | 2 | ChEMBL | 528 | 5 | 3 | 9 | 3.1 | Cc1ccc(CNC(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)cc1 | 10.1021/jm300323t | |||
| 60154835 | 77197 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -17 | 2 | ChEMBL | 507 | 3 | 2 | 10 | 1.2 | CN1CCN(C(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)CC1 | 10.1021/jm300323t | |||
| CHEMBL2071051 | 77197 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -17 | 2 | ChEMBL | 507 | 3 | 2 | 10 | 1.2 | CN1CCN(C(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)CC1 | 10.1021/jm300323t | |||
| CHEMBL2079181 | 77197 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | -17 | 2 | ChEMBL | 507 | 3 | 2 | 10 | 1.2 | CN1CCN(C(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)CC1 | 10.1021/jm300323t | |||
| 46883159 | 5837 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | 2 | 2 | ChEMBL | 360 | 5 | 1 | 6 | 4.2 | Cc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)cc1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079142 | 5837 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | 2 | 2 | ChEMBL | 360 | 5 | 1 | 6 | 4.2 | Cc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)cc1 | 10.1016/j.bmcl.2009.08.040 | |||
| 136042337 | 71161 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 520 | 10 | 1 | 12 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4noc(-c5cccc(OC)c5)n4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955913 | 71161 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 520 | 10 | 1 | 12 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4noc(-c5cccc(OC)c5)n4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 136042330 | 71154 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 506 | 9 | 3 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)O)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955905 | 71154 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 506 | 9 | 3 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)O)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 10544916 | 188307 | None | 0 | Rat | Functional | pIC50 | = | 6.7 | 6.7 | -15 | 2 | ChEMBL | 337 | 1 | 2 | 7 | 2.3 | Cn1c(-c2ccco2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL50051 | 188307 | None | 0 | Rat | Functional | pIC50 | = | 6.7 | 6.7 | -15 | 2 | ChEMBL | 337 | 1 | 2 | 7 | 2.3 | Cn1c(-c2ccco2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 9839545 | 137310 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 307 | 4 | 2 | 8 | 2.0 | Nc1nc(NCc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL3752514 | 137310 | None | 0 | Human | Functional | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 307 | 4 | 2 | 8 | 2.0 | Nc1nc(NCc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| 135874422 | 159083 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)c(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL409736 | 159083 | None | 0 | Human | Functional | pIC50 | = | 6.7 | 6.7 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)c(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 49797796 | 10615 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 391 | 4 | 1 | 4 | 4.7 | CCN(C(C)=O)c1ccc(Cl)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170130 | 10615 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 391 | 4 | 1 | 4 | 4.7 | CCN(C(C)=O)c1ccc(Cl)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797878 | 10780 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 415 | 6 | 1 | 5 | 4.7 | COc1ccc(N(CC(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171718 | 10780 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 415 | 6 | 1 | 5 | 4.7 | COc1ccc(N(CC(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 9842054 | 183938 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 10 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL48153 | 183938 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | 10 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 44186719 | 185914 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 552 | 7 | 2 | 9 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486893 | 185914 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 552 | 7 | 2 | 9 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 49797854 | 10847 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 409 | 5 | 1 | 5 | 4.3 | COc1ccc(N(C(C)=O)C(F)F)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172268 | 10847 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 409 | 5 | 1 | 5 | 4.3 | COc1ccc(N(C(C)=O)C(F)F)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 136042348 | 71174 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 508 | 9 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc5c(c4)OCO5)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955926 | 71174 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 508 | 9 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc5c(c4)OCO5)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 145962202 | 161536 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -64 | 3 | ChEMBL | 363 | 5 | 2 | 7 | 4.0 | COc1cccc(CNc2nc(N)c3nc(-c4ccccc4)sc3n2)c1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4128596 | 161536 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -64 | 3 | ChEMBL | 363 | 5 | 2 | 7 | 4.0 | COc1cccc(CNc2nc(N)c3nc(-c4ccccc4)sc3n2)c1 | 10.1016/j.bmc.2018.05.048 | |||
| 156821341 | 186414 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -2 | 2 | ChEMBL | 461 | 4 | 2 | 9 | 2.5 | Cn1cc(-c2c(-c3ccc(F)cc3)nc(N)n3nc([C@H](O)c4ncccc4F)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4876080 | 186414 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -2 | 2 | ChEMBL | 461 | 4 | 2 | 9 | 2.5 | Cn1cc(-c2c(-c3ccc(F)cc3)nc(N)n3nc([C@H](O)c4ncccc4F)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00620 | |||
| 134138275 | 147751 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -1 | 2 | ChEMBL | 339 | 4 | 3 | 8 | 3.2 | Nc1nc(NCc2cccc(O)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3932413 | 147751 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | -1 | 2 | ChEMBL | 339 | 4 | 3 | 8 | 3.2 | Nc1nc(NCc2cccc(O)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 60155712 | 76959 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -9 | 2 | ChEMBL | 381 | 3 | 3 | 9 | 1.1 | Cn1cc2c(nc(NC(=O)NC3CCNCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2070880 | 76959 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -9 | 2 | ChEMBL | 381 | 3 | 3 | 9 | 1.1 | Cn1cc2c(nc(NC(=O)NC3CCNCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 11497239 | 11810 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 390 | 3 | 2 | 8 | 1.7 | Cn1cc2c(nc(NC(=O)Nc3ccc[n+](C)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL1181982 | 11810 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 390 | 3 | 2 | 8 | 1.7 | Cn1cc2c(nc(NC(=O)Nc3ccc[n+](C)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL203660 | 11810 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 390 | 3 | 2 | 8 | 1.7 | Cn1cc2c(nc(NC(=O)Nc3ccc[n+](C)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| 118708238 | 113366 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -57 | 2 | ChEMBL | 345 | 5 | 2 | 6 | 3.3 | Nc1nc(CCCc2ccccc2O)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317578 | 113366 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -57 | 2 | ChEMBL | 345 | 5 | 2 | 6 | 3.3 | Nc1nc(CCCc2ccccc2O)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 134142611 | 145883 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 353 | 5 | 3 | 8 | 3.3 | Nc1nc(NCCc2cccc(O)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3917647 | 145883 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 353 | 5 | 3 | 8 | 3.3 | Nc1nc(NCCc2cccc(O)c2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 11625796 | 74699 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 414 | 3 | 2 | 9 | 3.7 | Cn1cc2c(nc(NC(=O)Nc3cc4ccccc4o3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL203054 | 74699 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 414 | 3 | 2 | 9 | 3.7 | Cn1cc2c(nc(NC(=O)Nc3cc4ccccc4o3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| 11733496 | 24903 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 477 | 8 | 1 | 8 | 4.5 | O=C(Cc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL134566 | 24903 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 477 | 8 | 1 | 8 | 4.5 | O=C(Cc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 9842054 | 183938 | None | 0 | Rat | Functional | pIC50 | = | 6.6 | 6.6 | -10 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL48153 | 183938 | None | 0 | Rat | Functional | pIC50 | = | 6.6 | 6.6 | -10 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 57391653 | 69776 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 358 | 5 | 1 | 7 | 3.6 | Nc1nc2cn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935746 | 69776 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 358 | 5 | 1 | 7 | 3.6 | Nc1nc2cn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| 25231169 | 5512 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 2 | 2 | ChEMBL | 325 | 5 | 2 | 6 | 2.6 | O=C(NC1CC1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1076503 | 5512 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | 2 | 2 | ChEMBL | 325 | 5 | 2 | 6 | 2.6 | O=C(NC1CC1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 136002248 | 71156 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 564 | 8 | 2 | 9 | 4.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955907 | 71156 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 564 | 8 | 2 | 9 | 4.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 54585057 | 60731 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 562 | 7 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](NC(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760898 | 60731 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 562 | 7 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@@H](NC(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 11560202 | 74700 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 391 | 3 | 2 | 9 | 1.5 | Cn1cc2c(nc(NC(=O)Nc3ccc[n+]([O-])c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL203060 | 74700 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 391 | 3 | 2 | 9 | 1.5 | Cn1cc2c(nc(NC(=O)Nc3ccc[n+]([O-])c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| 145977111 | 163763 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4205635 | 163763 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 145962355 | 161434 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -416 | 3 | ChEMBL | 363 | 5 | 2 | 7 | 4.0 | COc1ccccc1CNc1nc(N)c2nc(-c3ccccc3)sc2n1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4127213 | 161434 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | -416 | 3 | ChEMBL | 363 | 5 | 2 | 7 | 4.0 | COc1ccccc1CNc1nc(N)c2nc(-c3ccccc3)sc2n1 | 10.1016/j.bmc.2018.05.048 | |||
| 135874428 | 167560 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL430044 | 167560 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 57403905 | 69793 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2cn(CCc3ccccc3)nc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935762 | 69793 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2cn(CCc3ccccc3)nc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| 136042346 | 71172 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 461 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955924 | 71172 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 461 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 46238064 | 8508 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -5 | 2 | ChEMBL | 405 | 5 | 1 | 5 | 4.8 | O=C(Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12)c1ccccc1 | 10.1021/jm901785w | |||
| CHEMBL1094143 | 8508 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -5 | 2 | ChEMBL | 405 | 5 | 1 | 5 | 4.8 | O=C(Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12)c1ccccc1 | 10.1021/jm901785w | |||
| 145972655 | 163028 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 369 | 5 | 2 | 8 | 4.0 | COc1cccc(CNc2nc(N)c3nc(-c4cccs4)sc3n2)c1 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4175878 | 163028 | None | 0 | Human | Functional | pIC50 | = | 5.6 | 5.6 | - | 1 | ChEMBL | 369 | 5 | 2 | 8 | 4.0 | COc1cccc(CNc2nc(N)c3nc(-c4cccs4)sc3n2)c1 | 10.1016/j.ejmech.2018.06.020 | |||
| 49797794 | 10586 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 394 | 5 | 1 | 6 | 3.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C#N)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1169934 | 10586 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 394 | 5 | 1 | 6 | 3.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C#N)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797750 | 10751 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 437 | 6 | 1 | 9 | 2.9 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cnnn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171349 | 10751 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 437 | 6 | 1 | 9 | 2.9 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cnnn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797772 | 10854 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 466 | 7 | 1 | 6 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN4CCCC4=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172276 | 10854 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 466 | 7 | 1 | 6 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN4CCCC4=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 156017813 | 177825 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 402 | 5 | 3 | 9 | 2.2 | Nc1nc(NCc2ccc(S(N)(=O)=O)cc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4643898 | 177825 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 402 | 5 | 3 | 9 | 2.2 | Nc1nc(NCc2ccc(S(N)(=O)=O)cc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 54585057 | 60729 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 562 | 7 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NC(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760895 | 60729 | None | 0 | Human | Functional | pIC50 | = | 7.6 | 7.6 | - | 1 | ChEMBL | 562 | 7 | 2 | 6 | 5.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NC(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 11684980 | 12311 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 390 | 3 | 2 | 8 | 1.7 | Cn1cc2c(nc(NC(=O)Nc3cccc[n+]3C)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL1185010 | 12311 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 390 | 3 | 2 | 8 | 1.7 | Cn1cc2c(nc(NC(=O)Nc3cccc[n+]3C)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL383689 | 12311 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 390 | 3 | 2 | 8 | 1.7 | Cn1cc2c(nc(NC(=O)Nc3cccc[n+]3C)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| 164611330 | 185082 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -380 | 2 | ChEMBL | 418 | 4 | 2 | 6 | 3.4 | Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)[nH]c2)c2nc(CCC(F)(F)F)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4855908 | 185082 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -380 | 2 | ChEMBL | 418 | 4 | 2 | 6 | 3.4 | Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)[nH]c2)c2nc(CCC(F)(F)F)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| 134138961 | 147622 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 353 | 5 | 2 | 8 | 3.5 | COc1ccc(CNc2nc(N)c3nc(-c4ccco4)sc3n2)cc1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3931329 | 147622 | None | 0 | Human | Functional | pIC50 | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 353 | 5 | 2 | 8 | 3.5 | COc1ccc(CNc2nc(N)c3nc(-c4ccco4)sc3n2)cc1 | 10.1021/acs.jmedchem.6b01068 | |||
| 46883071 | 5691 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 380 | 4 | 1 | 7 | 3.9 | Cc1ccc(C(=O)c2nc(NC(=O)c3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078001 | 5691 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 380 | 4 | 1 | 7 | 3.9 | Cc1ccc(C(=O)c2nc(NC(=O)c3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 49797904 | 10740 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(C)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171163 | 10740 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(C)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 127046050 | 140089 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -45 | 3 | ChEMBL | 335 | 4 | 1 | 7 | 3.0 | COc1cccc(Cn2cc3nc(-c4ccc(C)o4)nc(N)c3n2)c1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3800587 | 140089 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -45 | 3 | ChEMBL | 335 | 4 | 1 | 7 | 3.0 | COc1cccc(Cn2cc3nc(-c4ccc(C)o4)nc(N)c3n2)c1 | 10.1016/j.bmc.2016.04.048 | |||
| 56964576 | 74724 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 372 | 2 | 0 | 5 | 4.4 | O=c1c(-c2ccccc2)nnc2n(-c3ccccc3)c3ccc(Cl)cc3n12 | 10.1021/jm201177b | |||
| CHEMBL2030707 | 74724 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 372 | 2 | 0 | 5 | 4.4 | O=c1c(-c2ccccc2)nnc2n(-c3ccccc3)c3ccc(Cl)cc3n12 | 10.1021/jm201177b | |||
| 44186626 | 184607 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL484900 | 184607 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 25207803 | 5683 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | 10 | 4 | ChEMBL | 381 | 6 | 2 | 8 | 4.0 | CNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077943 | 5683 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | 10 | 4 | ChEMBL | 381 | 6 | 2 | 8 | 4.0 | CNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 44186669 | 185795 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486688 | 185795 | None | 0 | Human | Functional | pIC50 | = | 8.5 | 8.5 | - | 1 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186581 | 3203 | None | 27 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 6561 | 3203 | None | 27 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL482436 | 3203 | None | 27 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 53248699 | 63101 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760897 | 63101 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1789197 | 63101 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 4355631 | 193768 | None | 2 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 3 | ChEMBL | 320 | 2 | 0 | 6 | 2.2 | COC(=O)C1=C2C=CN(C)C=C2c2nc(-c3ccccc3)nn2C1 | 10.1021/jm990499b | |||
| CHEMBL52735 | 193768 | None | 2 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 1 | 3 | ChEMBL | 320 | 2 | 0 | 6 | 2.2 | COC(=O)C1=C2C=CN(C)C=C2c2nc(-c3ccccc3)nn2C1 | 10.1021/jm990499b | |||
| 25230180 | 5956 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 2 | 2 | ChEMBL | 353 | 4 | 1 | 6 | 3.5 | C[C@@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079893 | 5956 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | 2 | 2 | ChEMBL | 353 | 4 | 1 | 6 | 3.5 | C[C@@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 | 10.1016/j.bmcl.2009.08.040 | |||
| 25231170 | 5513 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | 8 | 2 | ChEMBL | 327 | 5 | 2 | 6 | 2.8 | CC(C)NC(=O)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1076504 | 5513 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | 8 | 2 | ChEMBL | 327 | 5 | 2 | 6 | 2.8 | CC(C)NC(=O)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 57396935 | 69783 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1ncc2nc(N)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935752 | 69783 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1ncc2nc(N)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| 132991405 | 151061 | None | 3 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -6165 | 2 | ChEMBL | 353 | 5 | 2 | 8 | 3.5 | COc1ccccc1CNc1nc(N)c2nc(-c3ccco3)sc2n1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3958838 | 151061 | None | 3 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -6165 | 2 | ChEMBL | 353 | 5 | 2 | 8 | 3.5 | COc1ccccc1CNc1nc(N)c2nc(-c3ccco3)sc2n1 | 10.1021/acs.jmedchem.6b01068 | |||
| 118708239 | 113367 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -109 | 2 | ChEMBL | 345 | 5 | 2 | 6 | 3.3 | Nc1nc(CCCc2cccc(O)c2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317579 | 113367 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -109 | 2 | ChEMBL | 345 | 5 | 2 | 6 | 3.3 | Nc1nc(CCCc2cccc(O)c2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 57391694 | 69785 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2cnn(CCc3ccccc3)c2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935754 | 69785 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2cnn(CCc3ccccc3)c2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| 57403904 | 69788 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1ncc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935757 | 69788 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1ncc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| 57398676 | 69794 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Nc1nc2cn(CCCc3ccccc3)nc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935763 | 69794 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Nc1nc2cn(CCCc3ccccc3)nc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| 25230949 | 6003 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 15 | 4 | ChEMBL | 367 | 5 | 2 | 8 | 3.6 | Nc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1080241 | 6003 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | 15 | 4 | ChEMBL | 367 | 5 | 2 | 8 | 3.6 | Nc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 136042333 | 71158 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 514 | 8 | 2 | 9 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955909 | 71158 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 514 | 8 | 2 | 9 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 134147788 | 149989 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 323 | 4 | 2 | 7 | 3.5 | Nc1nc(NCc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3950142 | 149989 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 323 | 4 | 2 | 7 | 3.5 | Nc1nc(NCc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 71601630 | 86920 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.ejmech.2015.11.015 | |||
| CHEMBL2322916 | 86920 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.ejmech.2015.11.015 | |||
| 71601630 | 86920 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL2322916 | 86920 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.bmc.2016.04.048 | |||
| 71601630 | 86920 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL2322916 | 86920 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.ejmech.2014.07.060 | |||
| 44408316 | 75403 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 391 | 3 | 2 | 9 | 1.5 | Cn1cc2c(nc(NC(=O)Nc3cccc[n+]3[O-])n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| CHEMBL203998 | 75403 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 391 | 3 | 2 | 9 | 1.5 | Cn1cc2c(nc(NC(=O)Nc3cccc[n+]3[O-])n3nc(-c4ccco4)nc23)n1 | 10.1021/jm051147+ | |||
| 10687707 | 110355 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 328 | 2 | 0 | 6 | 3.3 | O=c1c(-c2ccco2)nnc2n(-c3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL324100 | 110355 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 328 | 2 | 0 | 6 | 3.3 | O=c1c(-c2ccco2)nnc2n(-c3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 11716665 | 2279 | None | 37 | Human | Functional | pIC50 | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 5617 | 2279 | None | 37 | Human | Functional | pIC50 | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| CHEMBL375293 | 2279 | None | 37 | Human | Functional | pIC50 | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 135522362 | 100019 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286838 | 100019 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 134151346 | 151569 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 275 | 4 | 2 | 7 | 2.8 | CCCNc1nc(N)c2nc(-c3ccco3)sc2n1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3963278 | 151569 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 275 | 4 | 2 | 7 | 2.8 | CCCNc1nc(N)c2nc(-c3ccco3)sc2n1 | 10.1021/acs.jmedchem.6b01068 | |||
| 60154742 | 77169 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -39 | 2 | ChEMBL | 501 | 4 | 3 | 10 | 2.5 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)Nc4ccncc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2071050 | 77169 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -39 | 2 | ChEMBL | 501 | 4 | 3 | 10 | 2.5 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)Nc4ccncc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2078766 | 77169 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -39 | 2 | ChEMBL | 501 | 4 | 3 | 10 | 2.5 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)Nc4ccncc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 60154740 | 76987 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -95 | 2 | ChEMBL | 544 | 6 | 3 | 10 | 2.8 | COc1ccc(CNC(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)cc1 | 10.1021/jm300323t | |||
| CHEMBL2071049 | 76987 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | -95 | 2 | ChEMBL | 544 | 6 | 3 | 10 | 2.8 | COc1ccc(CNC(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)cc1 | 10.1021/jm300323t | |||
| 57402161 | 69791 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1cc2nc(N)n3nc(-c4ccco4)nc3c2n1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935760 | 69791 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1cc2nc(N)n3nc(-c4ccco4)nc3c2n1 | 10.1016/j.bmc.2011.11.037 | |||
| 10126989 | 10764 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 417 | 7 | 1 | 6 | 3.7 | COCCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171526 | 10764 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 417 | 7 | 1 | 6 | 3.7 | COCCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 145971923 | 163016 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 324 | 4 | 2 | 8 | 2.9 | Nc1nc(NCc2ccncc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4175676 | 163016 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | 324 | 4 | 2 | 8 | 2.9 | Nc1nc(NCc2ccncc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 118708236 | 113364 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -138 | 2 | ChEMBL | 359 | 6 | 1 | 6 | 3.6 | COc1cccc(CCCc2nc(N)c3nn(-c4ccccc4)cc3n2)c1 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317576 | 113364 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | -138 | 2 | ChEMBL | 359 | 6 | 1 | 6 | 3.6 | COc1cccc(CCCc2nc(N)c3nn(-c4ccccc4)cc3n2)c1 | 10.1016/j.ejmech.2014.07.060 | |||
| 156017042 | 177756 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 450 | 5 | 1 | 10 | 3.4 | CCOC(=O)c1ccc(N2CCN(c3nc(N)c4nc(-c5ccco5)sc4n3)CC2)cc1 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4642713 | 177756 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 450 | 5 | 1 | 10 | 3.4 | CCOC(=O)c1ccc(N2CCN(c3nc(N)c4nc(-c5ccco5)sc4n3)CC2)cc1 | 10.1016/j.bmcl.2020.127067 | |||
| 156010442 | 177041 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 416 | 6 | 3 | 9 | 2.2 | Nc1nc(NCCc2ccc(S(N)(=O)=O)cc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4632532 | 177041 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 416 | 6 | 3 | 9 | 2.2 | Nc1nc(NCCc2ccc(S(N)(=O)=O)cc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 11716665 | 2279 | None | 37 | Mouse | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 5617 | 2279 | None | 37 | Mouse | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| CHEMBL375293 | 2279 | None | 37 | Mouse | Functional | pIC50 | = | 6.5 | 6.5 | -1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 49797793 | 10852 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 427 | 6 | 1 | 7 | 3.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)OC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172274 | 10852 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 427 | 6 | 1 | 7 | 3.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)OC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 136042329 | 71153 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 534 | 10 | 2 | 11 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)OCC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955904 | 71153 | None | 0 | Human | Functional | pIC50 | = | 7.5 | 7.5 | - | 1 | ChEMBL | 534 | 10 | 2 | 11 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)OCC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 22283414 | 10661 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170518 | 10661 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797825 | 10664 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 430 | 6 | 2 | 6 | 2.8 | CNC(=O)CN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170525 | 10664 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 430 | 6 | 2 | 6 | 2.8 | CNC(=O)CN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 22283414 | 10661 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1170518 | 10661 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 145961997 | 161553 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 301 | 4 | 2 | 7 | 2.6 | COc1cccc(CNc2nc(N)c3nc(C)sc3n2)c1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4128787 | 161553 | None | 0 | Human | Functional | pIC50 | = | 5.5 | 5.5 | - | 1 | ChEMBL | 301 | 4 | 2 | 7 | 2.6 | COc1cccc(CNc2nc(N)c3nc(C)sc3n2)c1 | 10.1016/j.bmc.2018.05.048 | |||
| 127045699 | 139633 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.2 | Cc1ccc(-c2nc(N)c3nn(Cc4ccccc4F)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3797666 | 139633 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.2 | Cc1ccc(-c2nc(N)c3nn(Cc4ccccc4F)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| 145963230 | 161505 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 333 | 4 | 2 | 6 | 3.9 | Nc1nc(NCc2ccccc2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4128138 | 161505 | None | 0 | Human | Functional | pIC50 | = | 6.5 | 6.5 | - | 1 | ChEMBL | 333 | 4 | 2 | 6 | 3.9 | Nc1nc(NCc2ccccc2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| 49797795 | 10614 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 447 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170129 | 10614 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 447 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 25230951 | 150297 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 5 | 4 | ChEMBL | 380 | 6 | 1 | 7 | 4.6 | CCc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| CHEMBL3952824 | 150297 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 5 | 4 | ChEMBL | 380 | 6 | 1 | 7 | 4.6 | CCc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| 45481750 | 198562 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 449 | 5 | 1 | 8 | 4.0 | Cn1cc2c(nc(NC(=O)C(c3ccccc3)c3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL578224 | 198562 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 449 | 5 | 1 | 8 | 4.0 | Cn1cc2c(nc(NC(=O)C(c3ccccc3)c3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46882996 | 5637 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | 1 | 2 | ChEMBL | 288 | 3 | 0 | 5 | 3.9 | CCc1nc(C(=O)c2ccc(C)s2)c2sccc2n1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077750 | 5637 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | 1 | 2 | ChEMBL | 288 | 3 | 0 | 5 | 3.9 | CCc1nc(C(=O)c2ccc(C)s2)c2sccc2n1 | 10.1016/j.bmcl.2009.08.040 | |||
| 49797774 | 10620 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 462 | 7 | 2 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(NS(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170137 | 10620 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 462 | 7 | 2 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(NS(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 145961339 | 161563 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 257 | 2 | 2 | 6 | 2.7 | Cc1nc2c(N)nc(Nc3ccccc3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4128862 | 161563 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 257 | 2 | 2 | 6 | 2.7 | Cc1nc2c(N)nc(Nc3ccccc3)nc2s1 | 10.1016/j.bmc.2018.05.048 | |||
| 49798139 | 10670 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 495 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCN(C)CC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170583 | 10670 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 495 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCN(C)CC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 135484064 | 2614 | None | 4 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| 390 | 2614 | None | 4 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| 136042353 | 71151 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 530 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955902 | 71151 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 530 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135484064 | 2614 | None | 4 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| 390 | 2614 | None | 4 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| 118708235 | 113363 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -32 | 2 | ChEMBL | 359 | 6 | 1 | 6 | 3.6 | COc1ccccc1CCCc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317575 | 113363 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -32 | 2 | ChEMBL | 359 | 6 | 1 | 6 | 3.6 | COc1ccccc1CCCc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1016/j.ejmech.2014.07.060 | |||
| 134149255 | 148162 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -16 | 2 | ChEMBL | 337 | 5 | 2 | 7 | 3.6 | Nc1nc(NCCc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3935610 | 148162 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -16 | 2 | ChEMBL | 337 | 5 | 2 | 7 | 3.6 | Nc1nc(NCCc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 145954398 | 162593 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 367 | 5 | 2 | 8 | 3.9 | COc1ccccc1CNc1nc(N)c2nc(-c3ccc(C)o3)sc2n1 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4168980 | 162593 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 367 | 5 | 2 | 8 | 3.9 | COc1ccccc1CNc1nc(N)c2nc(-c3ccc(C)o3)sc2n1 | 10.1016/j.ejmech.2018.06.020 | |||
| 25230881 | 6175 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 1 | 4 | ChEMBL | 395 | 6 | 1 | 8 | 4.1 | CN(C)c1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1081160 | 6175 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 1 | 4 | ChEMBL | 395 | 6 | 1 | 8 | 4.1 | CN(C)c1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 127045909 | 139986 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 321 | 3 | 2 | 7 | 2.7 | Cc1ccc(-c2nc(N)c3nn(Cc4ccccc4O)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3799921 | 139986 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 321 | 3 | 2 | 7 | 2.7 | Cc1ccc(-c2nc(N)c3nn(Cc4ccccc4O)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| 156821369 | 185621 | None | 2 | Human | Functional | pIC50 | = | 8.4 | 8.4 | -14 | 2 | ChEMBL | 447 | 4 | 2 | 7 | 3.5 | Nc1nc(-c2ccccc2)c(-c2ccc(=O)[nH]c2)c2nc(Cc3ncc(F)cc3Cl)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4864129 | 185621 | None | 2 | Human | Functional | pIC50 | = | 8.4 | 8.4 | -14 | 2 | ChEMBL | 447 | 4 | 2 | 7 | 3.5 | Nc1nc(-c2ccccc2)c(-c2ccc(=O)[nH]c2)c2nc(Cc3ncc(F)cc3Cl)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| 145436763 | 162195 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | -13 | 2 | ChEMBL | 338 | 5 | 2 | 8 | 3.0 | Nc1nc(NCCc2cccnc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4162638 | 162195 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | -13 | 2 | ChEMBL | 338 | 5 | 2 | 8 | 3.0 | Nc1nc(NCCc2cccnc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 44186579 | 191782 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 494 | 6 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL519813 | 191782 | None | 0 | Human | Functional | pIC50 | = | 8.4 | 8.4 | - | 1 | ChEMBL | 494 | 6 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 57400352 | 69784 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 12 | 2 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCCn1ncc2nc(N)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935753 | 69784 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 12 | 2 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCCn1ncc2nc(N)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| 49797855 | 10848 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 441 | 5 | 1 | 5 | 4.6 | COc1ccc(N(CC(F)(F)F)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172269 | 10848 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 441 | 5 | 1 | 5 | 4.6 | COc1ccc(N(CC(F)(F)F)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 135522368 | 492 | None | 1 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| 383 | 492 | None | 1 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| CHEMBL33491 | 492 | None | 1 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| 11371101 | 67565 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 336 | 4 | 0 | 6 | 2.2 | CCCn1c(=O)c2c(nc3n2CC(C)=C3)n(Cc2ccccc2)c1=O | 10.1016/j.bmc.2008.10.049 | |||
| CHEMBL189904 | 67565 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 336 | 4 | 0 | 6 | 2.2 | CCCn1c(=O)c2c(nc3n2CC(C)=C3)n(Cc2ccccc2)c1=O | 10.1016/j.bmc.2008.10.049 | |||
| 11371101 | 67565 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 336 | 4 | 0 | 6 | 2.2 | CCCn1c(=O)c2c(nc3n2CC(C)=C3)n(Cc2ccccc2)c1=O | 10.1021/jm058008c | |||
| CHEMBL189904 | 67565 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 336 | 4 | 0 | 6 | 2.2 | CCCn1c(=O)c2c(nc3n2CC(C)=C3)n(Cc2ccccc2)c1=O | 10.1021/jm058008c | |||
| 145961748 | 161509 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 365 | 5 | 2 | 9 | 2.7 | COc1ccccc1CNc1nc(N)c2nc(-c3cnccn3)sc2n1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4128190 | 161509 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 365 | 5 | 2 | 9 | 2.7 | COc1ccccc1CNc1nc(N)c2nc(-c3cnccn3)sc2n1 | 10.1016/j.bmc.2018.05.048 | |||
| 54586036 | 60722 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 534 | 6 | 1 | 6 | 4.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760887 | 60722 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 534 | 6 | 1 | 6 | 4.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10761800 | 188217 | None | 0 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -5 | 2 | ChEMBL | 372 | 1 | 2 | 7 | 2.5 | Cn1c(-c2cccc(C#N)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL49925 | 188217 | None | 0 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -5 | 2 | ChEMBL | 372 | 1 | 2 | 7 | 2.5 | Cn1c(-c2cccc(C#N)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 46883041 | 5731 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 2 | 2 | ChEMBL | 379 | 5 | 1 | 6 | 5.5 | Cc1ccc(C(=O)c2nc(NC(C)c3ccccc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078347 | 5731 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | 2 | 2 | ChEMBL | 379 | 5 | 1 | 6 | 5.5 | Cc1ccc(C(=O)c2nc(NC(C)c3ccccc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 46883074 | 5703 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1 | 2 | ChEMBL | 380 | 5 | 0 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(N(C)Cc3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078087 | 5703 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | -1 | 2 | ChEMBL | 380 | 5 | 0 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(N(C)Cc3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 57402117 | 69773 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 254 | 1 | 1 | 7 | 1.5 | Cn1cc2nc(N)n3nc(-c4ccco4)nc3c2c1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935743 | 69773 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 254 | 1 | 1 | 7 | 1.5 | Cn1cc2nc(N)n3nc(-c4ccco4)nc3c2c1 | 10.1016/j.bmc.2011.11.037 | |||
| 49797852 | 10762 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 417 | 7 | 2 | 6 | 3.4 | COc1ccc(N(CCCO)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171524 | 10762 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 417 | 7 | 2 | 6 | 3.4 | COc1ccc(N(CCCO)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 54587015 | 60720 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 570 | 7 | 1 | 7 | 4.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760885 | 60720 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 570 | 7 | 1 | 7 | 4.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 71601632 | 86922 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2015.11.015 | |||
| CHEMBL2322918 | 86922 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2015.11.015 | |||
| 71601632 | 86922 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL2322918 | 86922 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.bmc.2016.04.048 | |||
| 71601632 | 86922 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL2322918 | 86922 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 9841364 | 101455 | None | 1 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -6 | 2 | ChEMBL | 351 | 1 | 2 | 6 | 2.4 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL297685 | 101455 | None | 1 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -6 | 2 | ChEMBL | 351 | 1 | 2 | 6 | 2.4 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCC3)nc21 | 10.1021/jm990499b | |||
| 127045700 | 139720 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.2 | Cc1ccc(-c2nc(N)c3nn(Cc4cccc(F)c4)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3798214 | 139720 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.2 | Cc1ccc(-c2nc(N)c3nn(Cc4cccc(F)c4)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| 1329 | 1471 | None | 86 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.9b00106 | |||
| 386 | 1471 | None | 86 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.9b00106 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.9b00106 | |||
| DB12946 | 1471 | None | 86 | Human | Functional | pIC50 | = | 7.4 | 7.4 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.9b00106 | |||
| 135678052 | 95775 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258571 | 95775 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 46883042 | 5732 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 4 | 2 | ChEMBL | 366 | 5 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCc3ccccn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078348 | 5732 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | 4 | 2 | ChEMBL | 366 | 5 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCc3ccccn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 136042347 | 71173 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 482 | 9 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955925 | 71173 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 482 | 9 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 118708234 | 113362 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -10 | 3 | ChEMBL | 329 | 5 | 1 | 5 | 3.6 | Nc1nc(CCCc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317574 | 113362 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -10 | 3 | ChEMBL | 329 | 5 | 1 | 5 | 3.6 | Nc1nc(CCCc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 127035626 | 137316 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 426 | 6 | 3 | 8 | 4.0 | O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL3752621 | 137316 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 426 | 6 | 3 | 8 | 4.0 | O=C(Nc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| 145960873 | 161442 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 347 | 5 | 2 | 6 | 4.0 | Nc1nc(NCCc2ccccc2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4127351 | 161442 | None | 0 | Human | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 347 | 5 | 2 | 6 | 4.0 | Nc1nc(NCCc2ccccc2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| 54580150 | 60728 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 534 | 7 | 1 | 6 | 5.5 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(Cc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760894 | 60728 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 534 | 7 | 1 | 6 | 5.5 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(Cc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 71601631 | 86921 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2015.11.015 | |||
| CHEMBL2322917 | 86921 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2015.11.015 | |||
| 71601631 | 86921 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL2322917 | 86921 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.bmc.2016.04.048 | |||
| 71601631 | 86921 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL2322917 | 86921 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 10691124 | 101279 | None | 0 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -8 | 2 | ChEMBL | 379 | 1 | 2 | 6 | 3.2 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL296389 | 101279 | None | 0 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -8 | 2 | ChEMBL | 379 | 1 | 2 | 6 | 3.2 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCCC3)nc21 | 10.1021/jm990499b | |||
| 10618828 | 101986 | None | 0 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -5 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccccc2F)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL301512 | 101986 | None | 0 | Rat | Functional | pIC50 | = | 6.4 | 6.4 | -5 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccccc2F)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 10754589 | 193318 | None | 0 | Rat | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 271 | 0 | 2 | 6 | 1.0 | Cn1cnc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL52432 | 193318 | None | 0 | Rat | Functional | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 271 | 0 | 2 | 6 | 1.0 | Cn1cnc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 57396936 | 69792 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCCn1cc2nc(N)n3nc(-c4ccco4)nc3c2n1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935761 | 69792 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCCn1cc2nc(N)n3nc(-c4ccco4)nc3c2n1 | 10.1016/j.bmc.2011.11.037 | |||
| 136042354 | 71152 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955903 | 71152 | None | 0 | Human | Functional | pIC50 | = | 7.4 | 7.4 | - | 1 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 46883073 | 5702 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 380 | 6 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCCc3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078086 | 5702 | None | 0 | Human | Functional | pIC50 | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 380 | 6 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCCc3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 132991406 | 144211 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -4786 | 2 | ChEMBL | 353 | 5 | 2 | 8 | 3.5 | COc1cccc(CNc2nc(N)c3nc(-c4ccco4)sc3n2)c1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3904408 | 144211 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -4786 | 2 | ChEMBL | 353 | 5 | 2 | 8 | 3.5 | COc1cccc(CNc2nc(N)c3nc(-c4ccco4)sc3n2)c1 | 10.1021/acs.jmedchem.6b01068 | |||
| 145958464 | 162157 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | -1174 | 2 | ChEMBL | 369 | 5 | 2 | 8 | 4.0 | COc1ccccc1CNc1nc(N)c2nc(-c3cccs3)sc2n1 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4162037 | 162157 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | -1174 | 2 | ChEMBL | 369 | 5 | 2 | 8 | 4.0 | COc1ccccc1CNc1nc(N)c2nc(-c3cccs3)sc2n1 | 10.1016/j.ejmech.2018.06.020 | |||
| 57396888 | 69775 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 344 | 4 | 1 | 7 | 3.2 | Nc1nc2cn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935745 | 69775 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 344 | 4 | 1 | 7 | 3.2 | Nc1nc2cn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| 135522375 | 114255 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 525 | 11 | 2 | 11 | 2.1 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33305 | 114255 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 525 | 11 | 2 | 11 | 2.1 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 46883109 | 5832 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 2 | 2 | ChEMBL | 350 | 5 | 1 | 7 | 3.8 | Cc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)o1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079117 | 5832 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 2 | 2 | ChEMBL | 350 | 5 | 1 | 7 | 3.8 | Cc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)o1 | 10.1016/j.bmcl.2009.08.040 | |||
| 134132667 | 144581 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 367 | 6 | 2 | 8 | 3.6 | COc1cccc(CCNc2nc(N)c3nc(-c4ccco4)sc3n2)c1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3907658 | 144581 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 367 | 6 | 2 | 8 | 3.6 | COc1cccc(CCNc2nc(N)c3nc(-c4ccco4)sc3n2)c1 | 10.1021/acs.jmedchem.6b01068 | |||
| 10175278 | 170382 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 588 | 9 | 2 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL444787 | 170382 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 588 | 9 | 2 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL5075422 | 214370 | None | 3 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -83 | 4 | ChEMBL | None | None | None | Cn1cc(-c2cnc(N)n3nc(-c4ccco4)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00599 | |||||
| 176407 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.6b01068 | |||
| 405 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.6b01068 | |||
| DB08770 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.6b01068 | |||
| 134132684 | 144718 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -20 | 2 | ChEMBL | 353 | 5 | 3 | 8 | 3.3 | Nc1nc(NCCc2ccc(O)cc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3908770 | 144718 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -20 | 2 | ChEMBL | 353 | 5 | 3 | 8 | 3.3 | Nc1nc(NCCc2ccc(O)cc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 46883108 | 5831 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 3 | 2 | ChEMBL | 386 | 5 | 1 | 7 | 4.6 | O=C(c1ccc(Cl)s1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079116 | 5831 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 3 | 2 | ChEMBL | 386 | 5 | 1 | 7 | 4.6 | O=C(c1ccc(Cl)s1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 54584125 | 60727 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 584 | 7 | 1 | 7 | 4.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760893 | 60727 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 584 | 7 | 1 | 7 | 4.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)C3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10691124 | 101279 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 8 | 2 | ChEMBL | 379 | 1 | 2 | 6 | 3.2 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL296389 | 101279 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 8 | 2 | ChEMBL | 379 | 1 | 2 | 6 | 3.2 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCCCC3)nc21 | 10.1021/jm990499b | |||
| 46237928 | 8807 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -42 | 2 | ChEMBL | 329 | 3 | 1 | 5 | 3.3 | Cn1cc2c(NC(=O)c3ccccc3)nc(-c3ccccc3)nc2n1 | 10.1021/jm901785w | |||
| CHEMBL1096754 | 8807 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -42 | 2 | ChEMBL | 329 | 3 | 1 | 5 | 3.3 | Cn1cc2c(NC(=O)c3ccccc3)nc(-c3ccccc3)nc2n1 | 10.1021/jm901785w | |||
| 10762430 | 189158 | None | 0 | Rat | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 381 | 1 | 2 | 6 | 3.3 | Cn1c(-c2cccc(Cl)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL51107 | 189158 | None | 0 | Rat | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 381 | 1 | 2 | 6 | 3.3 | Cn1c(-c2cccc(Cl)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 45481754 | 198149 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 477 | 7 | 1 | 8 | 4.9 | CCCn1cc2c(nc(NC(=O)C(c3ccccc3)c3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL574775 | 198149 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 477 | 7 | 1 | 8 | 4.9 | CCCn1cc2c(nc(NC(=O)C(c3ccccc3)c3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 25230098 | 6214 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 14 | 2 | ChEMBL | 299 | 4 | 2 | 6 | 2.1 | CNC(=O)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1081334 | 6214 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 14 | 2 | ChEMBL | 299 | 4 | 2 | 6 | 2.1 | CNC(=O)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 156010442 | 177041 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 416 | 6 | 3 | 9 | 2.2 | Nc1nc(NCCc2ccc(S(N)(=O)=O)cc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4632532 | 177041 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 416 | 6 | 3 | 9 | 2.2 | Nc1nc(NCCc2ccc(S(N)(=O)=O)cc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 44186716 | 184112 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 524 | 7 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL482648 | 184112 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 524 | 7 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186718 | 184171 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 538 | 6 | 2 | 9 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL483065 | 184171 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 538 | 6 | 2 | 9 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 57325914 | 74723 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 356 | 4 | 0 | 6 | 3.5 | O=c1c(-c2ccco2)nnc2n(CCc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL2030706 | 74723 | None | 0 | Human | Functional | pIC50 | = | 8.3 | 8.3 | - | 1 | ChEMBL | 356 | 4 | 0 | 6 | 3.5 | O=c1c(-c2ccco2)nnc2n(CCc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 10714900 | 189448 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 12 | 2 | ChEMBL | 381 | 1 | 2 | 6 | 3.3 | Cn1c(-c2ccc(Cl)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL51353 | 189448 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 12 | 2 | ChEMBL | 381 | 1 | 2 | 6 | 3.3 | Cn1c(-c2ccc(Cl)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 45482074 | 198300 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 511 | 8 | 1 | 8 | 5.2 | O=C(Cc1cccc(Cl)c1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL576017 | 198300 | None | 0 | Human | Functional | pIC50 | = | 4.3 | 4.3 | - | 1 | ChEMBL | 511 | 8 | 1 | 8 | 5.2 | O=C(Cc1cccc(Cl)c1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2009.05.038 | |||
| 145960746 | 161602 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 365 | 5 | 2 | 9 | 2.7 | COc1cccc(CNc2nc(N)c3nc(-c4cnccn4)sc3n2)c1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4129565 | 161602 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 365 | 5 | 2 | 9 | 2.7 | COc1cccc(CNc2nc(N)c3nc(-c4cnccn4)sc3n2)c1 | 10.1016/j.bmc.2018.05.048 | |||
| 60154738 | 76985 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -5 | 2 | ChEMBL | 548 | 5 | 3 | 9 | 3.4 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCc4ccc(Cl)cc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL2071047 | 76985 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -5 | 2 | ChEMBL | 548 | 5 | 3 | 9 | 3.4 | Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)NCc4ccc(Cl)cc4)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 45482464 | 198530 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 447 | 7 | 1 | 8 | 4.1 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL578005 | 198530 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 447 | 7 | 1 | 8 | 4.1 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 136042341 | 71165 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 517 | 8 | 2 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955917 | 71165 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 517 | 8 | 2 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 176407 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2018.06.020 | |||
| 405 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2018.06.020 | |||
| DB08770 | 4146 | None | 84 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2018.06.020 | |||
| 10616023 | 101860 | None | 0 | Rat | Functional | pIC50 | = | 6.3 | 6.3 | -3 | 2 | ChEMBL | 325 | 1 | 2 | 6 | 1.9 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC(C)(C)O)nc21 | 10.1021/jm990499b | |||
| CHEMBL300624 | 101860 | None | 0 | Rat | Functional | pIC50 | = | 6.3 | 6.3 | -3 | 2 | ChEMBL | 325 | 1 | 2 | 6 | 1.9 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC(C)(C)O)nc21 | 10.1021/jm990499b | |||
| 46883158 | 5836 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 3 | 2 | ChEMBL | 346 | 5 | 1 | 6 | 3.9 | O=C(c1ccccc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079141 | 5836 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | 3 | 2 | ChEMBL | 346 | 5 | 1 | 6 | 3.9 | O=C(c1ccccc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 127046493 | 139795 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -83 | 3 | ChEMBL | 321 | 4 | 1 | 7 | 2.7 | COc1ccccc1Cn1cc2nc(-c3ccco3)nc(N)c2n1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3798766 | 139795 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -83 | 3 | ChEMBL | 321 | 4 | 1 | 7 | 2.7 | COc1ccccc1Cn1cc2nc(-c3ccco3)nc(N)c2n1 | 10.1016/j.bmc.2016.04.048 | |||
| 16071896 | 58023 | None | 44 | Mouse | Functional | pIC50 | = | 6.3 | 6.3 | -4 | 2 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672627 | 58023 | None | 44 | Mouse | Functional | pIC50 | = | 6.3 | 6.3 | -4 | 2 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 25230950 | 152743 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 4 | ChEMBL | 378 | 6 | 1 | 7 | 4.6 | C=Cc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| CHEMBL3973260 | 152743 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 3 | 4 | ChEMBL | 378 | 6 | 1 | 7 | 4.6 | C=Cc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| 136042334 | 71159 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 490 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)c(C)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955910 | 71159 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 490 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)c(C)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 46237929 | 8954 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -138 | 2 | ChEMBL | 359 | 4 | 1 | 6 | 3.3 | COc1ccc(C(=O)Nc2nc(-c3ccccc3)nc3nn(C)cc23)cc1 | 10.1021/jm901785w | |||
| CHEMBL1098108 | 8954 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | -138 | 2 | ChEMBL | 359 | 4 | 1 | 6 | 3.3 | COc1ccc(C(=O)Nc2nc(-c3ccccc3)nc3nn(C)cc23)cc1 | 10.1021/jm901785w | |||
| 10633978 | 185875 | None | 0 | Rat | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 243 | 1 | 1 | 5 | 1.8 | Cn1c(-c2cccc(F)c2)nc2c(N)ncnc21 | 10.1021/jm990499b | |||
| CHEMBL48682 | 185875 | None | 0 | Rat | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 243 | 1 | 1 | 5 | 1.8 | Cn1c(-c2cccc(F)c2)nc2c(N)ncnc21 | 10.1021/jm990499b | |||
| 45482080 | 198423 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 451 | 6 | 1 | 8 | 4.5 | CCCn1cc2c(nc(NC(=O)Cc3ccc4ccccc4c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL577135 | 198423 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 451 | 6 | 1 | 8 | 4.5 | CCCn1cc2c(nc(NC(=O)Cc3ccc4ccccc4c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46882994 | 5823 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | 1 | 2 | ChEMBL | 260 | 2 | 0 | 5 | 3.3 | Cc1ccc(C(=O)c2ncnc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1079059 | 5823 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | 1 | 2 | ChEMBL | 260 | 2 | 0 | 5 | 3.3 | Cc1ccc(C(=O)c2ncnc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 136042351 | 71149 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 492 | 9 | 2 | 10 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955900 | 71149 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 492 | 9 | 2 | 10 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 386674 | 111319 | None | 2 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 352 | 3 | 0 | 5 | 3.8 | O=c1c(-c2ccccc2)nnc2n(Cc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| CHEMBL326752 | 111319 | None | 2 | Human | Functional | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 352 | 3 | 0 | 5 | 3.8 | O=c1c(-c2ccccc2)nnc2n(Cc3ccccc3)c3ccccc3n12 | 10.1021/jm201177b | |||
| 10665761 | 189274 | None | 0 | Rat | Functional | pIC50 | = | 6.3 | 6.3 | -3 | 2 | ChEMBL | 353 | 3 | 2 | 6 | 2.7 | CCC(O)(C#Cc1nc(N)c2nc(-c3cccc(F)c3)n(C)c2n1)CC | 10.1021/jm990499b | |||
| CHEMBL51192 | 189274 | None | 0 | Rat | Functional | pIC50 | = | 6.3 | 6.3 | -3 | 2 | ChEMBL | 353 | 3 | 2 | 6 | 2.7 | CCC(O)(C#Cc1nc(N)c2nc(-c3cccc(F)c3)n(C)c2n1)CC | 10.1021/jm990499b | |||
| 145954098 | 162537 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -35 | 2 | ChEMBL | 345 | 4 | 2 | 8 | 4.1 | Nc1nc(NCc2cccs2)nc2sc(-c3cccs3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4168016 | 162537 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -35 | 2 | ChEMBL | 345 | 4 | 2 | 8 | 4.1 | Nc1nc(NCc2cccs2)nc2sc(-c3cccs3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 57402162 | 69797 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 494 | 7 | 2 | 9 | 4.6 | COc1ccc(NC(=O)Nc2nc3cn(CCc4ccccc4)nc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935766 | 69797 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | - | 1 | ChEMBL | 494 | 7 | 2 | 9 | 4.6 | COc1ccc(NC(=O)Nc2nc3cn(CCc4ccccc4)nc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| 44537897 | 198074 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 497 | 7 | 1 | 8 | 5.0 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL574263 | 198074 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 497 | 7 | 1 | 8 | 5.0 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46883043 | 5733 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 18 | 2 | ChEMBL | 366 | 5 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078349 | 5733 | None | 0 | Human | Functional | pIC50 | = | 7.3 | 7.3 | 18 | 2 | ChEMBL | 366 | 5 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCc3cccnc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 134138322 | 148037 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -15 | 2 | ChEMBL | 367 | 6 | 2 | 8 | 3.6 | COc1ccc(CCNc2nc(N)c3nc(-c4ccco4)sc3n2)cc1 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3934626 | 148037 | None | 0 | Human | Functional | pIC50 | = | 6.3 | 6.3 | -15 | 2 | ChEMBL | 367 | 6 | 2 | 8 | 3.6 | COc1ccc(CCNc2nc(N)c3nc(-c4ccco4)sc3n2)cc1 | 10.1021/acs.jmedchem.6b01068 | |||
| 145963661 | 161540 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 301 | 4 | 2 | 7 | 2.6 | COc1ccccc1CNc1nc(N)c2nc(C)sc2n1 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4128638 | 161540 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 301 | 4 | 2 | 7 | 2.6 | COc1ccccc1CNc1nc(N)c2nc(C)sc2n1 | 10.1016/j.bmc.2018.05.048 | |||
| 46883040 | 5685 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | 1 | 2 | ChEMBL | 365 | 5 | 1 | 6 | 4.9 | Cc1ccc(C(=O)c2nc(NCc3ccccc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077985 | 5685 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | 1 | 2 | ChEMBL | 365 | 5 | 1 | 6 | 4.9 | Cc1ccc(C(=O)c2nc(NCc3ccccc3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 10621771 | 193117 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 415 | 1 | 2 | 6 | 3.7 | Cn1c(-c2cccc(C(F)(F)F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL52276 | 193117 | None | 0 | Human | Functional | pIC50 | = | 5.3 | 5.3 | - | 1 | ChEMBL | 415 | 1 | 2 | 6 | 3.7 | Cn1c(-c2cccc(C(F)(F)F)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 25230100 | 6350 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | 5 | 2 | ChEMBL | 367 | 5 | 2 | 6 | 3.8 | O=C(NC1CCCCC1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1082063 | 6350 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | 5 | 2 | ChEMBL | 367 | 5 | 2 | 6 | 3.8 | O=C(NC1CCCCC1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 9970667 | 205279 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 276 | 1 | 0 | 5 | 2.2 | Cn1c2ccccc2n2c(=O)c(-c3ccccc3)nnc12 | 10.1021/jm201177b | |||
| CHEMBL7909 | 205279 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 276 | 1 | 0 | 5 | 2.2 | Cn1c2ccccc2n2c(=O)c(-c3ccccc3)nnc12 | 10.1021/jm201177b | |||
| 135874413 | 96388 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 449 | 8 | 2 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccccc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261810 | 96388 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 449 | 8 | 2 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccccc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 156018440 | 177850 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 457 | 4 | 2 | 10 | 1.9 | Nc1nc(N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| CHEMBL4644153 | 177850 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 457 | 4 | 2 | 10 | 1.9 | Nc1nc(N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)nc2sc(-c3ccco3)nc12 | 10.1016/j.bmcl.2020.127067 | |||
| 57395164 | 69795 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3cn(C)nc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935764 | 69795 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3cn(C)nc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| 45481760 | 198006 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 539 | 8 | 1 | 8 | 5.7 | O=C(Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12)C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL573780 | 198006 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 539 | 8 | 1 | 8 | 5.7 | O=C(Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12)C(c1ccccc1)c1ccccc1 | 10.1016/j.bmc.2009.05.038 | |||
| 57395162 | 69786 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Nc1nc2cnn(CCCc3ccccc3)c2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935755 | 69786 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Nc1nc2cnn(CCCc3ccccc3)c2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2011.11.037 | |||
| 49797905 | 10741 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171164 | 10741 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797905 | 10741 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1171164 | 10741 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 136042339 | 71163 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 483 | 8 | 2 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955915 | 71163 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 483 | 8 | 2 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 25230881 | 6175 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 1 | 4 | ChEMBL | 395 | 6 | 1 | 8 | 4.1 | CN(C)c1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| CHEMBL1081160 | 6175 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 1 | 4 | ChEMBL | 395 | 6 | 1 | 8 | 4.1 | CN(C)c1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| 25230948 | 6033 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 3 | 4 | ChEMBL | 395 | 7 | 2 | 8 | 4.4 | CCNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| CHEMBL1080421 | 6033 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 3 | 4 | ChEMBL | 395 | 7 | 2 | 8 | 4.4 | CCNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| 156821433 | 185992 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -12 | 2 | ChEMBL | 427 | 4 | 1 | 8 | 2.9 | Cn1cc(-c2c(-c3ccccc3)nc(N)n3nc(Cc4ncccc4F)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4870159 | 185992 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | -12 | 2 | ChEMBL | 427 | 4 | 1 | 8 | 2.9 | Cn1cc(-c2c(-c3ccccc3)nc(N)n3nc(Cc4ncccc4F)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00620 | |||
| 49797826 | 10665 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 416 | 6 | 2 | 6 | 2.5 | COc1ccc(N(CC(N)=O)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170526 | 10665 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 416 | 6 | 2 | 6 | 2.5 | COc1ccc(N(CC(N)=O)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 136042331 | 71155 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C)cccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955906 | 71155 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C)cccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135489238 | 477 | None | 1 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| 381 | 477 | None | 1 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| CHEMBL32802 | 477 | None | 1 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| 49797797 | 10616 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 444 | 6 | 1 | 6 | 3.1 | COc1ccc(N(CC(=O)N(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170131 | 10616 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 444 | 6 | 1 | 6 | 3.1 | COc1ccc(N(CC(=O)N(C)C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797827 | 10640 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 417 | 6 | 2 | 6 | 3.1 | COc1ccc(N(CC(=O)O)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170295 | 10640 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 417 | 6 | 2 | 6 | 3.1 | COc1ccc(N(CC(=O)O)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 135874420 | 161300 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL412284 | 161300 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 136042328 | 71145 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 507 | 9 | 2 | 11 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc([N+](=O)[O-])ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955894 | 71145 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 507 | 9 | 2 | 11 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc([N+](=O)[O-])ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 136042352 | 71150 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 540 | 8 | 2 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955901 | 71150 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 540 | 8 | 2 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 156821338 | 185817 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | -8 | 2 | ChEMBL | 439 | 5 | 1 | 9 | 2.7 | COc1ccc(Cc2nc3c(-c4ccc(=O)n(C)c4)c(-c4ccccc4)nc(N)n3n2)nc1 | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4867286 | 185817 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | -8 | 2 | ChEMBL | 439 | 5 | 1 | 9 | 2.7 | COc1ccc(Cc2nc3c(-c4ccc(=O)n(C)c4)c(-c4ccccc4)nc(N)n3n2)nc1 | 10.1021/acsmedchemlett.1c00620 | |||
| 9841364 | 101455 | None | 1 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 6 | 2 | ChEMBL | 351 | 1 | 2 | 6 | 2.4 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL297685 | 101455 | None | 1 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 6 | 2 | ChEMBL | 351 | 1 | 2 | 6 | 2.4 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3(O)CCCC3)nc21 | 10.1021/jm990499b | |||
| 118708214 | 113351 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 211 | 1 | 1 | 5 | 1.4 | Nc1ncnc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| CHEMBL3317555 | 113351 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 211 | 1 | 1 | 5 | 1.4 | Nc1ncnc2cn(-c3ccccc3)nc12 | 10.1016/j.ejmech.2014.07.060 | |||
| 10714900 | 189448 | None | 0 | Rat | Functional | pIC50 | = | 5.2 | 5.2 | -12 | 2 | ChEMBL | 381 | 1 | 2 | 6 | 3.3 | Cn1c(-c2ccc(Cl)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL51353 | 189448 | None | 0 | Rat | Functional | pIC50 | = | 5.2 | 5.2 | -12 | 2 | ChEMBL | 381 | 1 | 2 | 6 | 3.3 | Cn1c(-c2ccc(Cl)cc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 134139825 | 146495 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 309 | 3 | 2 | 7 | 3.7 | Nc1nc(Nc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3922410 | 146495 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 309 | 3 | 2 | 7 | 3.7 | Nc1nc(Nc2ccccc2)nc2sc(-c3ccco3)nc12 | 10.1021/acs.jmedchem.6b01068 | |||
| 127045910 | 140037 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 321 | 3 | 2 | 7 | 2.7 | Cc1ccc(-c2nc(N)c3nn(Cc4cccc(O)c4)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| CHEMBL3800254 | 140037 | None | 0 | Human | Functional | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 321 | 3 | 2 | 7 | 2.7 | Cc1ccc(-c2nc(N)c3nn(Cc4cccc(O)c4)cc3n2)o1 | 10.1016/j.bmc.2016.04.048 | |||
| 136042344 | 71168 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 551 | 8 | 2 | 9 | 4.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955920 | 71168 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 551 | 8 | 2 | 9 | 4.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11716665 | 2279 | None | 37 | Mouse | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 5617 | 2279 | None | 37 | Mouse | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| CHEMBL375293 | 2279 | None | 37 | Mouse | Functional | pIC50 | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 45482087 | 198104 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 441 | 4 | 1 | 8 | 3.8 | Cn1cc2c(nc(NC(=O)Cc3c(Cl)cccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL574490 | 198104 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 441 | 4 | 1 | 8 | 3.8 | Cn1cc2c(nc(NC(=O)Cc3c(Cl)cccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 136042355 | 71146 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 462 | 8 | 2 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955897 | 71146 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 462 | 8 | 2 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135443367 | 487 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 382 | 487 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 135874416 | 96386 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 467 | 8 | 2 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(F)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261809 | 96386 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 467 | 8 | 2 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(F)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 25230952 | 146550 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 3 | 4 | ChEMBL | 458 | 8 | 2 | 9 | 5.0 | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2cc(NCc3cccnc3)sc12 | nan | |||
| CHEMBL3922797 | 146550 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | 3 | 4 | ChEMBL | 458 | 8 | 2 | 9 | 5.0 | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2cc(NCc3cccnc3)sc12 | nan | |||
| 49797879 | 10662 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 358 | 5 | 2 | 5 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cc[nH]c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170519 | 10662 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | - | 1 | ChEMBL | 358 | 5 | 2 | 5 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cc[nH]c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 25230949 | 6003 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 15 | 4 | ChEMBL | 367 | 5 | 2 | 8 | 3.6 | Nc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| CHEMBL1080241 | 6003 | None | 0 | Human | Functional | pIC50 | = | 8.2 | 8.2 | 15 | 4 | ChEMBL | 367 | 5 | 2 | 8 | 3.6 | Nc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 | nan | |||
| 136042332 | 71157 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 598 | 8 | 2 | 9 | 4.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955908 | 71157 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 598 | 8 | 2 | 9 | 4.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135443367 | 487 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 382 | 487 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Functional | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 51051251 | 69287 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 321 | 3 | 2 | 8 | 1.6 | Nc1nc(NC(=O)c2ccccc2)n2nc(-c3ccco3)nc2n1 | 10.1021/jm101349u | |||
| CHEMBL1927634 | 69287 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 321 | 3 | 2 | 8 | 1.6 | Nc1nc(NC(=O)c2ccccc2)n2nc(-c3ccco3)nc2n1 | 10.1021/jm101349u | |||
| 51050844 | 69260 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 442 | 6 | 3 | 10 | 3.1 | CC(C)(C)OC(=O)NCC1CCC(CNc2nc(N)n3nc(-c4ccco4)nc3n2)CC1 | 10.1021/jm101349u | |||
| CHEMBL1927427 | 69260 | None | 0 | Human | Functional | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 442 | 6 | 3 | 10 | 3.1 | CC(C)(C)OC(=O)NCC1CCC(CNc2nc(N)n3nc(-c4ccco4)nc3n2)CC1 | 10.1021/jm101349u | |||
| 145960813 | 161348 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -1 | 3 | ChEMBL | 339 | 4 | 2 | 7 | 4.0 | Nc1nc(NCc2cccs2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4125975 | 161348 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -1 | 3 | ChEMBL | 339 | 4 | 2 | 7 | 4.0 | Nc1nc(NCc2cccs2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| 54587016 | 60725 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 520 | 7 | 1 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(Cc4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760890 | 60725 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 520 | 7 | 1 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(Cc4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 10761800 | 188217 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 5 | 2 | ChEMBL | 372 | 1 | 2 | 7 | 2.5 | Cn1c(-c2cccc(C#N)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL49925 | 188217 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 5 | 2 | ChEMBL | 372 | 1 | 2 | 7 | 2.5 | Cn1c(-c2cccc(C#N)c2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 10688203 | 101723 | None | 0 | Rat | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 335 | 1 | 1 | 5 | 3.3 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3CCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL299548 | 101723 | None | 0 | Rat | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 335 | 1 | 1 | 5 | 3.3 | Cn1c(-c2cccc(F)c2)nc2c(N)nc(C#CC3CCCC3)nc21 | 10.1021/jm990499b | |||
| 45482082 | 198221 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 465 | 7 | 1 | 8 | 4.9 | CCCCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL575386 | 198221 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 465 | 7 | 1 | 8 | 4.9 | CCCCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 136042338 | 71162 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 449 | 8 | 2 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955914 | 71162 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 449 | 8 | 2 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 57402118 | 69779 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 493 | 7 | 2 | 8 | 5.2 | COc1ccc(NC(=O)Nc2nc3cn(CCc4ccccc4)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935749 | 69779 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 493 | 7 | 2 | 8 | 5.2 | COc1ccc(NC(=O)Nc2nc3cn(CCc4ccccc4)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| 135546649 | 116634 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33695 | 116634 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 145436760 | 162140 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -2089 | 2 | ChEMBL | 329 | 4 | 2 | 8 | 3.6 | Nc1nc(NCc2cccs2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4161758 | 162140 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -2089 | 2 | ChEMBL | 329 | 4 | 2 | 8 | 3.6 | Nc1nc(NCc2cccs2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 10570068 | 185882 | None | 0 | Rat | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 353 | 1 | 2 | 7 | 2.7 | Cn1c(-c2cccs2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL48683 | 185882 | None | 0 | Rat | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 353 | 1 | 2 | 7 | 2.7 | Cn1c(-c2cccs2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 145962310 | 161366 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 363 | 5 | 3 | 7 | 3.7 | Nc1nc(NCCc2ccc(O)cc2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4126116 | 161366 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 363 | 5 | 3 | 7 | 3.7 | Nc1nc(NCCc2ccc(O)cc2)nc2sc(-c3ccccc3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| 46882997 | 5638 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -3 | 2 | ChEMBL | 275 | 2 | 1 | 6 | 2.9 | Cc1ccc(C(=O)c2nc(N)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077751 | 5638 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -3 | 2 | ChEMBL | 275 | 2 | 1 | 6 | 2.9 | Cc1ccc(C(=O)c2nc(N)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 10807613 | 189494 | None | 0 | Rat | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 347 | 1 | 2 | 6 | 2.7 | Cn1c(-c2ccccc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL51394 | 189494 | None | 0 | Rat | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 347 | 1 | 2 | 6 | 2.7 | Cn1c(-c2ccccc2)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 127035806 | 137372 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 425 | 7 | 2 | 8 | 3.6 | O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL3753079 | 137372 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 425 | 7 | 2 | 8 | 3.6 | O=C(Cc1ccccc1)Nc1nc(NCc2ccccc2)nc2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2015.12.019 | |||
| 49797853 | 10846 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 403 | 6 | 2 | 6 | 3.0 | COc1ccc(N(CCO)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172267 | 10846 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 403 | 6 | 2 | 6 | 3.0 | COc1ccc(N(CCO)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 10618828 | 101986 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 5 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccccc2F)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| CHEMBL301512 | 101986 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | 5 | 2 | ChEMBL | 365 | 1 | 2 | 6 | 2.8 | Cn1c(-c2ccccc2F)nc2c(N)nc(C#CC3(O)CCCCC3)nc21 | 10.1021/jm990499b | |||
| 57393433 | 69789 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 494 | 7 | 2 | 9 | 4.6 | COc1ccc(NC(=O)Nc2nc3cnn(CCc4ccccc4)c3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935758 | 69789 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 494 | 7 | 2 | 9 | 4.6 | COc1ccc(NC(=O)Nc2nc3cnn(CCc4ccccc4)c3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| 45481621 | 197907 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 491 | 8 | 1 | 8 | 5.3 | CCCCn1cc2c(nc(NC(=O)C(c3ccccc3)c3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL572906 | 197907 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 491 | 8 | 1 | 8 | 5.3 | CCCCn1cc2c(nc(NC(=O)C(c3ccccc3)c3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 145961937 | 161454 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 341 | 4 | 2 | 9 | 2.8 | Nc1nc(NCc2cccs2)nc2sc(-c3cnccn3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| CHEMBL4127472 | 161454 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | - | 1 | ChEMBL | 341 | 4 | 2 | 9 | 2.8 | Nc1nc(NCc2cccs2)nc2sc(-c3cnccn3)nc12 | 10.1016/j.bmc.2018.05.048 | |||
| 57325915 | 74725 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 362 | 2 | 0 | 6 | 3.9 | O=c1c(-c2ccco2)nnc2n(-c3ccccc3)c3ccc(Cl)cc3n12 | 10.1021/jm201177b | |||
| CHEMBL2030708 | 74725 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 362 | 2 | 0 | 6 | 3.9 | O=c1c(-c2ccco2)nnc2n(-c3ccccc3)c3ccc(Cl)cc3n12 | 10.1021/jm201177b | |||
| 49797828 | 10763 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 431 | 6 | 1 | 7 | 3.2 | COC(=O)CN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171525 | 10763 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 431 | 6 | 1 | 7 | 3.2 | COC(=O)CN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 136042343 | 71167 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 501 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955919 | 71167 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 501 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 54582166 | 60723 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 548 | 7 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@H](NC(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760888 | 60723 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 548 | 7 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@H](NC(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 54581143 | 60724 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 548 | 7 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@@H](NC(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760889 | 60724 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 548 | 7 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CC[C@@H](NC(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 53248700 | 60732 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 536 | 5 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760899 | 60732 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 536 | 5 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 156821421 | 186217 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -16 | 2 | ChEMBL | 443 | 4 | 2 | 9 | 2.4 | Cn1cc(-c2c(-c3ccccc3)nc(N)n3nc([C@H](O)c4ncccc4F)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4873266 | 186217 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -16 | 2 | ChEMBL | 443 | 4 | 2 | 9 | 2.4 | Cn1cc(-c2c(-c3ccccc3)nc(N)n3nc([C@H](O)c4ncccc4F)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00620 | |||
| 145436764 | 161985 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -22 | 2 | ChEMBL | 329 | 4 | 2 | 8 | 3.6 | Nc1nc(NCc2ccsc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4159215 | 161985 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | -22 | 2 | ChEMBL | 329 | 4 | 2 | 8 | 3.6 | Nc1nc(NCc2ccsc2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 135874424 | 95846 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 469 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3ccn(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258987 | 95846 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 469 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3ccn(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 136042327 | 71144 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 512 | 8 | 2 | 9 | 3.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc6ccccc6cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955893 | 71144 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 512 | 8 | 2 | 9 | 3.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc6ccccc6cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135416058 | 491 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| 442 | 491 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| CHEMBL2113342 | 491 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| 5606 | 1642 | None | 17 | Rat | Functional | pIC50 | = | 5.1 | 5.1 | -316 | 7 | ChEMBL | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 10.1021/jm990499b | |||
| 6439091 | 1642 | None | 17 | Rat | Functional | pIC50 | = | 5.1 | 5.1 | -316 | 7 | ChEMBL | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 10.1021/jm990499b | |||
| CHEMBL440115 | 1642 | None | 17 | Rat | Functional | pIC50 | = | 5.1 | 5.1 | -316 | 7 | ChEMBL | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 10.1021/jm990499b | |||
| 145436769 | 162802 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -2041 | 2 | ChEMBL | 313 | 4 | 2 | 8 | 3.1 | Nc1nc(NCc2ccco2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4172399 | 162802 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | -2041 | 2 | ChEMBL | 313 | 4 | 2 | 8 | 3.1 | Nc1nc(NCc2ccco2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 56950235 | 69777 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -10 | 2 | ChEMBL | 403 | 4 | 2 | 8 | 3.5 | COc1ccc(NC(=O)Nc2nc3cn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935747 | 69777 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -10 | 2 | ChEMBL | 403 | 4 | 2 | 8 | 3.5 | COc1ccc(NC(=O)Nc2nc3cn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1016/j.bmc.2011.11.037 | |||
| 57400353 | 69796 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -3 | 2 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc3c2n1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935765 | 69796 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | -3 | 2 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc3c2n1 | 10.1016/j.bmc.2011.11.037 | |||
| 45481771 | 197959 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 491 | 8 | 1 | 8 | 5.4 | CCCCn1cc2c(nc(NC(=O)Cc3ccc(-c4ccccc4)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL573360 | 197959 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 491 | 8 | 1 | 8 | 5.4 | CCCCn1cc2c(nc(NC(=O)Cc3ccc(-c4ccccc4)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46883207 | 5977 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 2 | 2 | ChEMBL | 347 | 5 | 1 | 7 | 3.3 | O=C(c1ccncc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1080067 | 5977 | None | 0 | Human | Functional | pIC50 | = | 6.1 | 6.1 | 2 | 2 | ChEMBL | 347 | 5 | 1 | 7 | 3.3 | O=C(c1ccncc1)c1nc(NCc2cccnc2)nc2ccsc12 | 10.1016/j.bmcl.2009.08.040 | |||
| 135493279 | 100380 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL289903 | 100380 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135493279 | 100380 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL289903 | 100380 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 45481759 | 198341 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 505 | 8 | 1 | 8 | 5.6 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(-c4ccccc4)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL576351 | 198341 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 505 | 8 | 1 | 8 | 5.6 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccc(-c4ccccc4)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 45481753 | 198861 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 407 | 4 | 1 | 8 | 3.1 | Cn1cc2c(nc(NC(=O)Cc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL583960 | 198861 | None | 0 | Human | Functional | pIC50 | = | 5.1 | 5.1 | - | 1 | ChEMBL | 407 | 4 | 1 | 8 | 3.1 | Cn1cc2c(nc(NC(=O)Cc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 56951623 | 71171 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 331 | 5 | 2 | 6 | 1.0 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955923 | 71171 | None | 0 | Human | Functional | pIC50 | = | 8.1 | 8.1 | - | 1 | ChEMBL | 331 | 5 | 2 | 6 | 1.0 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 156821390 | 185234 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -30 | 2 | ChEMBL | 431 | 4 | 2 | 7 | 3.0 | Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)[nH]c2)c2nc(Cc3ccc(F)cn3)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4858144 | 185234 | None | 0 | Human | Functional | pIC50 | = | 8.0 | 8.0 | -30 | 2 | ChEMBL | 431 | 4 | 2 | 7 | 3.0 | Nc1nc(-c2ccc(F)cc2)c(-c2ccc(=O)[nH]c2)c2nc(Cc3ccc(F)cn3)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| 57398641 | 69774 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 282 | 3 | 1 | 7 | 2.3 | CCCn1cc2nc(N)n3nc(-c4ccco4)nc3c2c1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935744 | 69774 | None | 0 | Human | Functional | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 282 | 3 | 1 | 7 | 2.3 | CCCn1cc2nc(N)n3nc(-c4ccco4)nc3c2c1 | 10.1016/j.bmc.2011.11.037 | |||
| 156821411 | 185697 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -1 | 2 | ChEMBL | 373 | 4 | 1 | 8 | 2.6 | Nc1nc(-c2ccccc2)c(-c2ccnnc2)c2nc(CC3CCCO3)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| CHEMBL4865474 | 185697 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -1 | 2 | ChEMBL | 373 | 4 | 1 | 8 | 2.6 | Nc1nc(-c2ccccc2)c(-c2ccnnc2)c2nc(CC3CCCO3)nn12 | 10.1021/acsmedchemlett.1c00620 | |||
| 45482086 | 197864 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 421 | 7 | 1 | 9 | 3.8 | CCCCn1cc2c(nc(NC(=O)Cc3ccsc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL572601 | 197864 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 421 | 7 | 1 | 9 | 3.8 | CCCCn1cc2c(nc(NC(=O)Cc3ccsc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 57395120 | 69778 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -18 | 2 | ChEMBL | 431 | 6 | 2 | 8 | 4.4 | CCCn1cc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc3c2c1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935748 | 69778 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -18 | 2 | ChEMBL | 431 | 6 | 2 | 8 | 4.4 | CCCn1cc2nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc3c2c1 | 10.1016/j.bmc.2011.11.037 | |||
| 145949481 | 162828 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 343 | 4 | 2 | 8 | 3.9 | Cc1ccc(-c2nc3c(N)nc(NCc4cccs4)nc3s2)o1 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4172715 | 162828 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 343 | 4 | 2 | 8 | 3.9 | Cc1ccc(-c2nc3c(N)nc(NCc4cccs4)nc3s2)o1 | 10.1016/j.ejmech.2018.06.020 | |||
| 45482094 | 197837 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 497 | 7 | 1 | 8 | 4.8 | O=C(Cc1cccc(Cl)c1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL572386 | 197837 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 497 | 7 | 1 | 8 | 4.8 | O=C(Cc1cccc(Cl)c1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2009.05.038 | |||
| 57391695 | 69799 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 337 | 3 | 1 | 8 | 3.0 | Cn1ncc2nc(NC3CCCCC3)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL1935768 | 69799 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 337 | 3 | 1 | 8 | 3.0 | Cn1ncc2nc(NC3CCCCC3)n3nc(-c4ccco4)nc3c21 | 10.1016/j.bmc.2011.11.037 | |||
| 46883070 | 5678 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 1 | 2 | ChEMBL | 367 | 5 | 1 | 8 | 3.7 | Cc1ccc(C(=O)c2nc(NCc3ccncn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1077902 | 5678 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | 1 | 2 | ChEMBL | 367 | 5 | 1 | 8 | 3.7 | Cc1ccc(C(=O)c2nc(NCc3ccncn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 135443378 | 109635 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccccc5C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32229 | 109635 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccccc5C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 45481756 | 198206 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 393 | 5 | 1 | 9 | 3.0 | CCn1cc2c(nc(NC(=O)Cc3ccsc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| CHEMBL575198 | 198206 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 393 | 5 | 1 | 9 | 3.0 | CCn1cc2c(nc(NC(=O)Cc3ccsc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2009.05.038 | |||
| 46883072 | 5701 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -2 | 2 | ChEMBL | 380 | 6 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCCc3ccccn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| CHEMBL1078085 | 5701 | None | 0 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -2 | 2 | ChEMBL | 380 | 6 | 1 | 7 | 4.3 | Cc1ccc(C(=O)c2nc(NCCc3ccccn3)nc3ccsc23)s1 | 10.1016/j.bmcl.2009.08.040 | |||
| 136042349 | 71147 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 480 | 8 | 2 | 9 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955898 | 71147 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 480 | 8 | 2 | 9 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135522367 | 110661 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 493 | 8 | 2 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc5c(c4)OCO5)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32591 | 110661 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 493 | 8 | 2 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc5c(c4)OCO5)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 134133787 | 143486 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 397 | 7 | 2 | 9 | 3.6 | COc1ccc(CCNc2nc(N)c3nc(-c4ccco4)sc3n2)cc1OC | 10.1021/acs.jmedchem.6b01068 | |||
| CHEMBL3898647 | 143486 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 397 | 7 | 2 | 9 | 3.6 | COc1ccc(CCNc2nc(N)c3nc(-c4ccco4)sc3n2)cc1OC | 10.1021/acs.jmedchem.6b01068 | |||
| 145436766 | 162525 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -102 | 2 | ChEMBL | 324 | 4 | 2 | 8 | 2.9 | Nc1nc(NCc2ccccn2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| CHEMBL4167813 | 162525 | None | 0 | Human | Functional | pIC50 | = | 7.0 | 7.0 | -102 | 2 | ChEMBL | 324 | 4 | 2 | 8 | 2.9 | Nc1nc(NCc2ccccn2)nc2sc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.06.020 | |||
| 155516071 | 170047 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 389 | 5 | 3 | 8 | 1.4 | NCCC(=O)Nc1ccc(-c2cn3c(=O)n(-c4ccccc4)nc3c(N)n2)cc1 | 10.1021/acs.jmedchem.9b00778 | |||
| CHEMBL4442908 | 170047 | None | 0 | Human | Functional | pIC50 | = | 5.0 | 5.0 | - | 1 | ChEMBL | 389 | 5 | 3 | 8 | 1.4 | NCCC(=O)Nc1ccc(-c2cn3c(=O)n(-c4ccccc4)nc3c(N)n2)cc1 | 10.1021/acs.jmedchem.9b00778 | |||
| 10570586 | 189051 | None | 0 | Rat | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 361 | 1 | 2 | 6 | 3.0 | Cc1cccc(-c2nc3c(N)nc(C#CC4(O)CCCCC4)nc3n2C)c1 | 10.1021/jm990499b | |||
| CHEMBL50950 | 189051 | None | 0 | Rat | Functional | pIC50 | = | 6.0 | 6.0 | - | 1 | ChEMBL | 361 | 1 | 2 | 6 | 3.0 | Cc1cccc(-c2nc3c(N)nc(C#CC4(O)CCCCC4)nc3n2C)c1 | 10.1021/jm990499b | |||
| 5606 | 1642 | None | 17 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 7 | ChEMBL | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 10.1021/jm990499b | |||
| 6439091 | 1642 | None | 17 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 7 | ChEMBL | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 10.1021/jm990499b | |||
| CHEMBL440115 | 1642 | None | 17 | Human | Functional | pIC50 | = | 6.0 | 6.0 | -38 | 7 | ChEMBL | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 10.1021/jm990499b | |||
| 44587956 | 174770 | None | 0 | Rat | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 554 | 9 | 3 | 7 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL456125 | 174770 | None | 0 | Rat | Functional | pKd | = | 9.3 | 9.3 | - | 0 | ChEMBL | 554 | 9 | 3 | 7 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11632785 | 73534 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 0 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201721 | 73534 | None | 0 | Human | Functional | pKd | = | 8 | 8.0 | - | 0 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 136 | 3290 | None | 32 | Rat | Functional | pKd | = | 7.9 | 7.9 | - | 1 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| 223 | 3290 | None | 32 | Rat | Functional | pKd | = | 7.9 | 7.9 | - | 1 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| 643606 | 3290 | None | 32 | Rat | Functional | pKd | = | 7.9 | 7.9 | - | 1 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| CHEMBL10347 | 3290 | None | 32 | Rat | Functional | pKd | = | 7.9 | 7.9 | - | 1 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| 44574165 | 189465 | None | 0 | Rat | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL513681 | 189465 | None | 0 | Rat | Functional | pKd | = | 8.7 | 8.7 | - | 0 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 11684443 | 133157 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL370378 | 133157 | None | 0 | Human | Functional | pKd | = | 8.5 | 8.5 | - | 0 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11568001 | 72628 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 422 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199446 | 72628 | None | 0 | Human | Functional | pKd | = | 8.4 | 8.4 | - | 0 | ChEMBL | 422 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 21874557 | 3994 | None | 51 | Human | Functional | pKd | = | 7.5 | 7.5 | - | 0 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| 5612 | 3994 | None | 51 | Human | Functional | pKd | = | 7.5 | 7.5 | - | 0 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| CHEMBL447664 | 3994 | None | 51 | Human | Functional | pKd | = | 7.5 | 7.5 | - | 0 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| DB06625 | 3994 | None | 51 | Human | Functional | pKd | = | 7.5 | 7.5 | - | 0 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| 11642035 | 73542 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL201750 | 73542 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 11642035 | 73542 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL201750 | 73542 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 11568001 | 72628 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 422 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199446 | 72628 | None | 0 | Human | Functional | pKd | = | 8.3 | 8.3 | - | 0 | ChEMBL | 422 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11632785 | 73534 | None | 0 | Human | Functional | pKd | = | 7.3 | 7.3 | - | 0 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201721 | 73534 | None | 0 | Human | Functional | pKd | = | 7.3 | 7.3 | - | 0 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11649145 | 135202 | None | 0 | Human | Functional | pKd | = | 8.2 | 8.2 | - | 0 | ChEMBL | 508 | 8 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL372148 | 135202 | None | 0 | Human | Functional | pKd | = | 8.2 | 8.2 | - | 0 | ChEMBL | 508 | 8 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11640539 | 140897 | None | 0 | Human | Functional | pKd | = | 8.2 | 8.2 | - | 0 | ChEMBL | 429 | 5 | 2 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL382135 | 140897 | None | 0 | Human | Functional | pKd | = | 8.2 | 8.2 | - | 0 | ChEMBL | 429 | 5 | 2 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11640539 | 140897 | None | 0 | Human | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 429 | 5 | 2 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL382135 | 140897 | None | 0 | Human | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 429 | 5 | 2 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11649145 | 135202 | None | 0 | Human | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 508 | 8 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL372148 | 135202 | None | 0 | Human | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 508 | 8 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11684443 | 133157 | None | 0 | Human | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL370378 | 133157 | None | 0 | Human | Functional | pKd | = | 8.1 | 8.1 | - | 0 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 52950040 | 19158 | None | 0 | Human | Functional | pKi | = | 9.4 | 9.4 | - | 0 | ChEMBL | 523 | 10 | 2 | 5 | 6.1 | CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289569 | 19158 | None | 0 | Human | Functional | pKi | = | 9.4 | 9.4 | - | 0 | ChEMBL | 523 | 10 | 2 | 5 | 6.1 | CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 52945195 | 19177 | None | 0 | Human | Functional | pKi | = | 9.4 | 9.4 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 4.7 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)N[C@@H](CO)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289676 | 19177 | None | 0 | Human | Functional | pKi | = | 9.4 | 9.4 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 4.7 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)N[C@@H](CO)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 450 | 2968 | None | 9 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2010.04.039 | |||
| 454 | 2968 | None | 9 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2010.04.039 | |||
| 5311041 | 2968 | None | 9 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Functional | pKi | = | 9.3 | 9.3 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1016/j.ejmech.2010.04.039 | |||
| 44574165 | 189465 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(C)c1=O | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL513681 | 189465 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(C)c1=O | 10.1016/j.ejmech.2017.05.035 | |||
| 66894241 | 157811 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4083317 | 157811 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| 66894241 | 157811 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4083317 | 157811 | None | 0 | Human | Functional | pKi | = | 9.1 | 9.1 | - | 0 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 52946453 | 19221 | None | 0 | Human | Functional | pKi | = | 9 | 9.0 | - | 0 | ChEMBL | 521 | 9 | 2 | 5 | 5.6 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290001 | 19221 | None | 0 | Human | Functional | pKi | = | 9 | 9.0 | - | 0 | ChEMBL | 521 | 9 | 2 | 5 | 5.6 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.10.030 | |||
| 145958145 | 162075 | None | 0 | Human | Functional | pKi | = | 9.0 | 9.0 | - | 0 | ChEMBL | 606 | 7 | 1 | 9 | 4.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(O[C@@H](C)C(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4160732 | 162075 | None | 0 | Human | Functional | pKi | = | 9.0 | 9.0 | - | 0 | ChEMBL | 606 | 7 | 1 | 9 | 4.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(O[C@@H](C)C(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.ejmech.2017.05.035 | |||
| 50925499 | 19234 | None | 0 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 523 | 9 | 2 | 5 | 5.9 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290101 | 19234 | None | 0 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 523 | 9 | 2 | 5 | 5.9 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 3284 | 3214 | None | 35 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.0c02169 | |||
| 44185871 | 3214 | None | 35 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.0c02169 | |||
| 5728 | 3214 | None | 35 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.0c02169 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.0c02169 | |||
| 145971695 | 163026 | None | 0 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 496 | 5 | 2 | 6 | 3.4 | C[C@H](Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccc(Br)cc1 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4175851 | 163026 | None | 0 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 496 | 5 | 2 | 6 | 3.4 | C[C@H](Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccc(Br)cc1 | 10.1016/j.ejmech.2017.05.035 | |||
| 3287 | 2640 | None | 43 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1021/jm990421v | |||
| 5139184 | 2640 | None | 43 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1021/jm990421v | |||
| CHEMBL17002 | 2640 | None | 43 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1021/jm990421v | |||
| 3287 | 2640 | None | 43 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1016/j.ejmech.2010.04.039 | |||
| 5139184 | 2640 | None | 43 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL17002 | 2640 | None | 43 | Human | Functional | pKi | = | 8.9 | 8.9 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1016/j.ejmech.2010.04.039 | |||
| 9825550 | 57590 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 461 | 9 | 2 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16677 | 57590 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 461 | 9 | 2 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 10839296 | 58141 | None | 1 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 506 | 10 | 2 | 9 | 3.3 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16787 | 58141 | None | 1 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 506 | 10 | 2 | 9 | 3.3 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 52943652 | 19250 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290210 | 19250 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 9846447 | 58759 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 447 | 7 | 2 | 7 | 2.9 | CCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)[nH]c2n(CC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16866 | 58759 | None | 0 | Human | Functional | pKi | = | 8.8 | 8.8 | - | 0 | ChEMBL | 447 | 7 | 2 | 7 | 2.9 | CCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)[nH]c2n(CC)c1=O | 10.1021/jm990421v | |||
| 44236539 | 156790 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4070936 | 156790 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 145952391 | 162997 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL4175454 | 162997 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.ejmech.2017.05.035 | |||
| 44276476 | 168092 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 475 | 9 | 2 | 7 | 3.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL432664 | 168092 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 475 | 9 | 2 | 7 | 3.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 449 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm990421v | |||
| 453 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm990421v | |||
| 6603931 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm990421v | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm990421v | |||
| 449 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2010.04.039 | |||
| 453 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2010.04.039 | |||
| 6603931 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Functional | pKi | = | 8.7 | 8.7 | 1 | 4 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2010.04.039 | |||
| 52948915 | 19293 | None | 0 | Human | Functional | pKi | = | 8 | 8.0 | - | 0 | ChEMBL | 541 | 9 | 2 | 5 | 6.0 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290437 | 19293 | None | 0 | Human | Functional | pKi | = | 8 | 8.0 | - | 0 | ChEMBL | 541 | 9 | 2 | 5 | 6.0 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 145982075 | 166481 | None | 0 | Human | Functional | pKi | = | 6 | 6.0 | - | 0 | ChEMBL | 379 | 6 | 1 | 9 | 2.8 | CNc1ncc(C(=O)OCc2cccc(OC)c2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| CHEMBL4278340 | 166481 | None | 0 | Human | Functional | pKi | = | 6 | 6.0 | - | 0 | ChEMBL | 379 | 6 | 1 | 9 | 2.8 | CNc1ncc(C(=O)OCc2cccc(OC)c2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| 1329 | 1471 | None | 86 | Human | Functional | pKi | = | 6 | 6.0 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2009.02.030 | |||
| 386 | 1471 | None | 86 | Human | Functional | pKi | = | 6 | 6.0 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Functional | pKi | = | 6 | 6.0 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2009.02.030 | |||
| DB12946 | 1471 | None | 86 | Human | Functional | pKi | = | 6 | 6.0 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2009.02.030 | |||
| 137661874 | 159300 | None | 0 | Human | Functional | pKi | = | 6 | 6.0 | - | 0 | ChEMBL | 405 | 4 | 2 | 7 | 3.0 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4099688 | 159300 | None | 0 | Human | Functional | pKi | = | 6 | 6.0 | - | 0 | ChEMBL | 405 | 4 | 2 | 7 | 3.0 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 145980971 | 166533 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 383 | 5 | 1 | 8 | 3.4 | CNc1ncc(C(=O)OCc2cccc(Cl)c2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| CHEMBL4279340 | 166533 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 383 | 5 | 1 | 8 | 3.4 | CNc1ncc(C(=O)OCc2cccc(Cl)c2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| 145994259 | 167325 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 424 | 6 | 2 | 7 | 3.9 | CNc1ncc(C(=O)NC(c2ccccc2)c2ccccc2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| CHEMBL4294246 | 167325 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 424 | 6 | 2 | 7 | 3.9 | CNc1ncc(C(=O)NC(c2ccccc2)c2ccccc2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| 118707857 | 113233 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 315 | 5 | 1 | 8 | 2.4 | CCOC(=O)c1cnc(NC(C)C)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314890 | 113233 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 315 | 5 | 1 | 8 | 2.4 | CCOC(=O)c1cnc(NC(C)C)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 118707863 | 113239 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 377 | 6 | 1 | 8 | 3.5 | CCOC(=O)c1cnc(NCc2ccc(C)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314896 | 113239 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 377 | 6 | 1 | 8 | 3.5 | CCOC(=O)c1cnc(NCc2ccc(C)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 155532918 | 171800 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 480 | 6 | 2 | 10 | 4.0 | Cn1cc2c(nc(NCC3CCC(CNC(=O)OC(C)(C)C)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1039/C9MD00014C | |||
| CHEMBL4468152 | 171800 | None | 0 | Human | Functional | pKi | = | 5 | 5.0 | - | 0 | ChEMBL | 480 | 6 | 2 | 10 | 4.0 | Cn1cc2c(nc(NCC3CCC(CNC(=O)OC(C)(C)C)CC3)n3nc(-c4ccco4)nc23)n1 | 10.1039/C9MD00014C | |||
| 52949999 | 19123 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 572 | 9 | 1 | 5 | 5.1 | CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289343 | 19123 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 572 | 9 | 1 | 5 | 5.1 | CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11687483 | 163013 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 253 | 3 | 1 | 5 | 2.5 | CCCn1c(-c2ccccc2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4175631 | 163013 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 253 | 3 | 1 | 5 | 2.5 | CCCn1c(-c2ccccc2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 2519 | 778 | None | 86 | Human | Functional | pKi | = | 5.0 | 5.0 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.04.039 | |||
| 407 | 778 | None | 86 | Human | Functional | pKi | = | 5.0 | 5.0 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.04.039 | |||
| 463 | 778 | None | 86 | Human | Functional | pKi | = | 5.0 | 5.0 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL113 | 778 | None | 86 | Human | Functional | pKi | = | 5.0 | 5.0 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.04.039 | |||
| DB00201 | 778 | None | 86 | Human | Functional | pKi | = | 5.0 | 5.0 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.04.039 | |||
| 44572292 | 171410 | None | 1 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 255 | 1 | 1 | 5 | 1.8 | CC(C)n1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL446264 | 171410 | None | 1 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 255 | 1 | 1 | 5 | 1.8 | CC(C)n1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 123683 | 3119 | None | 63 | Human | Functional | pKi | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.ejmech.2018.08.042 | |||
| 422 | 3119 | None | 63 | Human | Functional | pKi | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.ejmech.2018.08.042 | |||
| CHEMBL119709 | 3119 | None | 63 | Human | Functional | pKi | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.ejmech.2018.08.042 | |||
| DB05511 | 3119 | None | 63 | Human | Functional | pKi | = | 5.0 | 5.0 | -1258 | 5 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.ejmech.2018.08.042 | |||
| 71455624 | 82951 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 309 | 3 | 1 | 8 | 2.2 | Cn1cc2c(nc(NC3CCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181159 | 82951 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 309 | 3 | 1 | 8 | 2.2 | Cn1cc2c(nc(NC3CCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 22002449 | 113219 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 273 | 3 | 1 | 8 | 1.1 | CCOC(=O)c1cnc(N)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314876 | 113219 | None | 0 | Human | Functional | pKi | = | 6.0 | 6.0 | - | 0 | ChEMBL | 273 | 3 | 1 | 8 | 1.1 | CCOC(=O)c1cnc(N)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 823558 | 15242 | None | 9 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | 271 | 2 | 2 | 6 | 0.8 | COc1ccc2c(C)nc(NC3=NCC(=O)N3)nc2c1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL1210817 | 15242 | None | 9 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | 271 | 2 | 2 | 6 | 0.8 | COc1ccc2c(C)nc(NC3=NCC(=O)N3)nc2c1 | 10.1016/j.ejmech.2010.04.039 | |||
| 10475082 | 74 | None | 23 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 383 | 4 | 4 | 9 | 0.8 | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 5591 | 74 | None | 23 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 383 | 4 | 4 | 9 | 0.8 | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL251997 | 74 | None | 23 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 383 | 4 | 4 | 9 | 0.8 | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 155562044 | 175768 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 426 | 7 | 2 | 10 | 3.0 | Cn1cc2c(nc(NCCCCNC(=O)OC(C)(C)C)n3nc(-c4ccco4)nc23)n1 | 10.1039/C9MD00014C | |||
| CHEMBL4583657 | 175768 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 426 | 7 | 2 | 10 | 3.0 | Cn1cc2c(nc(NCCCCNC(=O)OC(C)(C)C)n3nc(-c4ccco4)nc23)n1 | 10.1039/C9MD00014C | |||
| 11681113 | 162256 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 309 | 4 | 1 | 6 | 2.7 | CCn1c(-c2ccccc2)nc2c(NC3CCOC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4163630 | 162256 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 309 | 4 | 1 | 6 | 2.7 | CCn1c(-c2ccccc2)nc2c(NC3CCOC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 118707845 | 113220 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 377 | 4 | 3 | 7 | 2.4 | CNC(=O)c1cnc(NC(=O)Nc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314877 | 113220 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 377 | 4 | 3 | 7 | 2.4 | CNC(=O)c1cnc(NC(=O)Nc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 44572295 | 189040 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 269 | 2 | 1 | 5 | 2.1 | CCC(C)n1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL509367 | 189040 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 269 | 2 | 1 | 5 | 2.1 | CCC(C)n1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 44447535 | 95004 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 458 | 5 | 4 | 11 | 0.2 | CNC(=S)OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL254896 | 95004 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 458 | 5 | 4 | 11 | 0.2 | CNC(=S)OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| 71457390 | 82921 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.4 | C[C@@H](Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12)c1ccccc1 | 10.1021/jm300899q | |||
| CHEMBL2180932 | 82921 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.4 | C[C@@H](Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12)c1ccccc1 | 10.1021/jm300899q | |||
| 49863226 | 15216 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 311 | 3 | 1 | 9 | 0.6 | Nc1nc(-n2cncn2)c2nnn(Cc3ccccc3F)c2n1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL1210734 | 15216 | None | 0 | Human | Functional | pKi | = | 5.9 | 5.9 | - | 0 | ChEMBL | 311 | 3 | 1 | 9 | 0.6 | Nc1nc(-n2cncn2)c2nnn(Cc3ccccc3F)c2n1 | 10.1016/j.ejmech.2010.04.039 | |||
| 22002364 | 113214 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 423 | 8 | 1 | 10 | 3.2 | CCOC(=O)c1cnc(NCc2ccc(OC)c(OC)c2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314871 | 113214 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 423 | 8 | 1 | 10 | 3.2 | CCOC(=O)c1cnc(NCc2ccc(OC)c(OC)c2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 11659363 | 162716 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 295 | 3 | 1 | 6 | 2.2 | Cn1c(-c2ccccc2)nc2c(NC3CCOC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4170873 | 162716 | None | 0 | Human | Functional | pKi | = | 4.9 | 4.9 | - | 0 | ChEMBL | 295 | 3 | 1 | 6 | 2.2 | Cn1c(-c2ccccc2)nc2c(NC3CCOC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 11568203 | 96242 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 432 | 5 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL260975 | 96242 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 432 | 5 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 66892244 | 158930 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 491 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4095686 | 158930 | None | 0 | Human | Functional | pKi | = | 7.9 | 7.9 | - | 0 | ChEMBL | 491 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 71412032 | 138270 | None | 4 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 294 | 4 | 4 | 9 | -1.4 | CCNC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00828 | |||
| CHEMBL3770601 | 138270 | None | 4 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 294 | 4 | 4 | 9 | -1.4 | CCNC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.5b00828 | |||
| 541903 | 57945 | None | 1 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 382 | 8 | 2 | 7 | 1.4 | C=CCn1c(=O)c2nc(-c3ccc(OCC(=O)O)cc3)[nH]c2n(CC=C)c1=O | 10.1021/jm990421v | |||
| CHEMBL16724 | 57945 | None | 1 | Human | Functional | pKi | = | 6.9 | 6.9 | - | 0 | ChEMBL | 382 | 8 | 2 | 7 | 1.4 | C=CCn1c(=O)c2nc(-c3ccc(OCC(=O)O)cc3)[nH]c2n(CC=C)c1=O | 10.1021/jm990421v | |||
| 11529450 | 162775 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 293 | 4 | 1 | 5 | 3.5 | CCn1c(-c2ccccc2)nc2c(NC3CCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4171919 | 162775 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 293 | 4 | 1 | 5 | 3.5 | CCn1c(-c2ccccc2)nc2c(NC3CCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 18440405 | 136617 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 374 | 6 | 2 | 6 | 3.2 | CCCn1c(Br)nc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3739795 | 136617 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 374 | 6 | 2 | 6 | 3.2 | CCCn1c(Br)nc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 52943652 | 19250 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290210 | 19250 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 9871761 | 59481 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 533 | 11 | 4 | 9 | 1.2 | CCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(CC(=O)NCCN)cc4)cc3)[nH]c2n(CC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17141 | 59481 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 533 | 11 | 4 | 9 | 1.2 | CCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(CC(=O)NCCN)cc4)cc3)[nH]c2n(CC)c1=O | 10.1021/jm990421v | |||
| 11610869 | 80254 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 393 | 5 | 3 | 8 | -1.0 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCC(=O)O)cc3)[nH]c2n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL213878 | 80254 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 393 | 5 | 3 | 8 | -1.0 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCC(=O)O)cc3)[nH]c2n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 9935943 | 59023 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 505 | 10 | 3 | 8 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(=O)O)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16931 | 59023 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 505 | 10 | 3 | 8 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(=O)O)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 541615 | 97523 | None | 1 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 385 | 8 | 2 | 7 | 1.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(N)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL27043 | 97523 | None | 1 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 385 | 8 | 2 | 7 | 1.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(N)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 10839228 | 59863 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 504 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)c2nc(-c3ccc(/C=C/C(=O)NN4C(=O)C(C)=C(C)C4=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17294 | 59863 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 504 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)c2nc(-c3ccc(/C=C/C(=O)NN4C(=O)C(C)=C(C)C4=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 414707 | 203638 | None | 13 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 0 | ChEMBL | 177 | 1 | 1 | 5 | 1.0 | CC(C)n1cnc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL67199 | 203638 | None | 13 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 0 | ChEMBL | 177 | 1 | 1 | 5 | 1.0 | CC(C)n1cnc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 118707866 | 113242 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 397 | 6 | 1 | 8 | 3.8 | CCOC(=O)c1cnc(NCc2ccc(Cl)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314899 | 113242 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 397 | 6 | 1 | 8 | 3.8 | CCOC(=O)c1cnc(NCc2ccc(Cl)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 317946 | 15215 | None | 4 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 272 | 1 | 1 | 7 | 0.3 | Cn1c(=O)c2c(nc(-c3ccccc3)n2O)n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL1210733 | 15215 | None | 4 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 272 | 1 | 1 | 7 | 0.3 | Cn1c(=O)c2c(nc(-c3ccccc3)n2O)n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 52950206 | 19109 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 476 | 8 | 2 | 5 | 3.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)Nc3ccccc3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289228 | 19109 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 476 | 8 | 2 | 5 | 3.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)Nc3ccccc3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 52946113 | 19269 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 522 | 8 | 3 | 4 | 6.2 | CC(C)(NC(=O)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290323 | 19269 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 522 | 8 | 3 | 4 | 6.2 | CC(C)(NC(=O)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL5080823 | 214705 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | None | None | None | CCCn1c(=O)c2nc(C34CCC(C(=O)NCCCN=[N+]=[N-])(CC3)CC4)[nH]c2n(CCCNC(=O)c2ccc(S(=O)(=O)F)cc2)c1=O | 10.1021/acs.jmedchem.0c02169 | |||||
| 247436 | 180245 | None | 30 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 177 | 2 | 1 | 5 | 0.8 | CCCn1cnc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 247436 | 180245 | None | 30 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 177 | 2 | 1 | 5 | 0.8 | CCCn1cnc2c(N)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL475023 | 180245 | None | 30 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 177 | 2 | 1 | 5 | 0.8 | CCCn1cnc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL475023 | 180245 | None | 30 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 177 | 2 | 1 | 5 | 0.8 | CCCn1cnc2c(N)ncnc21 | 10.1039/C5MD00034C | |||
| 452612 | 174501 | None | 16 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 0 | ChEMBL | 189 | 1 | 1 | 5 | 1.1 | Nc1ncnc2c1ncn2C1CCC1 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL455493 | 174501 | None | 16 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 0 | ChEMBL | 189 | 1 | 1 | 5 | 1.1 | Nc1ncnc2c1ncn2C1CCC1 | 10.1016/j.bmc.2009.02.030 | |||
| 52947452 | 19310 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 558 | 9 | 2 | 5 | 4.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290543 | 19310 | None | 0 | Human | Functional | pKi | = | 6.8 | 6.8 | - | 0 | ChEMBL | 558 | 9 | 2 | 5 | 4.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 1892 | 204043 | None | 78 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 0 | ChEMBL | 224 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCO)n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL699 | 204043 | None | 78 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 0 | ChEMBL | 224 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCO)n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 127038356 | 136708 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 360 | 5 | 2 | 6 | 3.2 | CCCn1c(Br)nc2c(N)nc(NCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3740631 | 136708 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 360 | 5 | 2 | 6 | 3.2 | CCCn1c(Br)nc2c(N)nc(NCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 71462774 | 82950 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 295 | 3 | 1 | 8 | 1.8 | Cn1cc2c(nc(NC3CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181158 | 82950 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 295 | 3 | 1 | 8 | 1.8 | Cn1cc2c(nc(NC3CC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 10624626 | 163135 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 482 | 8 | 2 | 7 | 3.1 | O=C(O)COc1ccc(-c2nc3c(=O)n(Cc4ccccc4)c(=O)n(Cc4ccccc4)c3[nH]2)cc1 | 10.1021/jm990421v | |||
| CHEMBL417812 | 163135 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 482 | 8 | 2 | 7 | 3.1 | O=C(O)COc1ccc(-c2nc3c(=O)n(Cc4ccccc4)c(=O)n(Cc4ccccc4)c3[nH]2)cc1 | 10.1021/jm990421v | |||
| 127042993 | 136629 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 333 | 6 | 1 | 6 | 4.1 | CCCn1c(-c2ccco2)nc2c(NCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3739903 | 136629 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 333 | 6 | 1 | 6 | 4.1 | CCCn1c(-c2ccco2)nc2c(NCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 127042996 | 136752 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 373 | 7 | 1 | 5 | 4.0 | CCCn1c(Br)nc2c(NCCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3741012 | 136752 | None | 0 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 373 | 7 | 1 | 5 | 4.0 | CCCn1c(Br)nc2c(NCCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 2840092 | 201047 | None | 43 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 245 | 3 | 3 | 4 | 1.6 | CCOc1cccc2c(C)nc(NC(=N)N)nc12 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL602578 | 201047 | None | 43 | Human | Functional | pKi | = | 5.8 | 5.8 | - | 0 | ChEMBL | 245 | 3 | 3 | 4 | 1.6 | CCOc1cccc2c(C)nc(NC(=N)N)nc12 | 10.1016/j.ejmech.2010.04.039 | |||
| 135438480 | 162916 | None | 0 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 1 | ChEMBL | 309 | 3 | 2 | 6 | 3.1 | Cn1c(-c2ccc(O)cc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4174108 | 162916 | None | 0 | Human | Functional | pKi | = | 4.8 | 4.8 | - | 1 | ChEMBL | 309 | 3 | 2 | 6 | 3.1 | Cn1c(-c2ccc(O)cc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 135610070 | 72299 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 377 | 8 | 2 | 9 | 0.8 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)O)no3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| CHEMBL198326 | 72299 | None | 0 | Human | Functional | pKi | = | 7.8 | 7.8 | - | 0 | ChEMBL | 377 | 8 | 2 | 9 | 0.8 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)O)no3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| 52947301 | 18977 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 517 | 9 | 2 | 4 | 5.8 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3cccnc3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1287832 | 18977 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 517 | 9 | 2 | 4 | 5.8 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3cccnc3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 127042997 | 136879 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 361 | 8 | 1 | 6 | 4.5 | CCCn1c(-c2ccco2)nc2c(NCCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3742158 | 136879 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 361 | 8 | 1 | 6 | 4.5 | CCCn1c(-c2ccco2)nc2c(NCCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 118707851 | 113226 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 392 | 5 | 2 | 8 | 3.2 | CCOC(=O)c1cnc(NC(=O)Nc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314883 | 113226 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 392 | 5 | 2 | 8 | 3.2 | CCOC(=O)c1cnc(NC(=O)Nc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 44572293 | 178428 | None | 1 | Human | Functional | pKi | = | 4.7 | 4.7 | - | 0 | ChEMBL | 191 | 2 | 1 | 5 | 1.4 | CCC(C)n1cnc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL466044 | 178428 | None | 1 | Human | Functional | pKi | = | 4.7 | 4.7 | - | 0 | ChEMBL | 191 | 2 | 1 | 5 | 1.4 | CCC(C)n1cnc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 66892382 | 159150 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC(F)(F)F)cc5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4098127 | 159150 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC(F)(F)F)cc5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 52946159 | 19291 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 493 | 9 | 2 | 4 | 5.7 | O=C(CCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290435 | 19291 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 493 | 9 | 2 | 4 | 5.7 | O=C(CCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 52949755 | 19236 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 468 | 6 | 2 | 5 | 3.2 | Cc1c(S(C)(=O)=O)c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290103 | 19236 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 468 | 6 | 2 | 5 | 3.2 | Cc1c(S(C)(=O)=O)c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| 118707865 | 113241 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 381 | 6 | 1 | 8 | 3.3 | CCOC(=O)c1cnc(NCc2ccc(F)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314898 | 113241 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 381 | 6 | 1 | 8 | 3.3 | CCOC(=O)c1cnc(NCc2ccc(F)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 9957239 | 59414 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 490 | 7 | 2 | 6 | 4.8 | O=C(O)/C=C/c1ccc(-c2nc3c(=O)n(CC4CCCCC4)c(=O)n(CC4CCCCC4)c3[nH]2)cc1 | 10.1021/jm990421v | |||
| CHEMBL17103 | 59414 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 490 | 7 | 2 | 6 | 4.8 | O=C(O)/C=C/c1ccc(-c2nc3c(=O)n(CC4CCCCC4)c(=O)n(CC4CCCCC4)c3[nH]2)cc1 | 10.1021/jm990421v | |||
| 136086750 | 8719 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 349 | 3 | 4 | 6 | 1.9 | N=C1c2c(C(N)=O)nc(-c3ccccc3O)n2CN1c1ccc(O)cc1 | 10.1016/j.bmc.2010.03.048 | |||
| CHEMBL1095872 | 8719 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 349 | 3 | 4 | 6 | 1.9 | N=C1c2c(C(N)=O)nc(-c3ccccc3O)n2CN1c1ccc(O)cc1 | 10.1016/j.bmc.2010.03.048 | |||
| 9912816 | 98432 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 475 | 10 | 2 | 7 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL275605 | 98432 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 475 | 10 | 2 | 7 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 11801496 | 98744 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 587 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL278039 | 98744 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 587 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 11801496 | 98744 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 587 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL278039 | 98744 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 587 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 10792296 | 98664 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 529 | 9 | 2 | 7 | 4.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(F)(F)F)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL277386 | 98664 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 529 | 9 | 2 | 7 | 4.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(F)(F)F)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 10767043 | 59021 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 479 | 9 | 2 | 7 | 3.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16929 | 59021 | None | 0 | Human | Functional | pKi | = | 8.7 | 8.7 | - | 0 | ChEMBL | 479 | 9 | 2 | 7 | 3.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 10840167 | 59176 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 539 | 9 | 2 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17003 | 59176 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 539 | 9 | 2 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 10720065 | 98395 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 495 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL275427 | 98395 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 495 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 9870718 | 59984 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccccc4C(C)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17341 | 59984 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccccc4C(C)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 72197880 | 90796 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 347 | 4 | 1 | 5 | 4.7 | O=C(Nc1nc(-c2ccccc2)c(-c2ccncc2)s1)c1ccco1 | 10.1016/j.ejmech.2013.03.020 | |||
| CHEMBL2391834 | 90796 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 347 | 4 | 1 | 5 | 4.7 | O=C(Nc1nc(-c2ccccc2)c(-c2ccncc2)s1)c1ccco1 | 10.1016/j.ejmech.2013.03.020 | |||
| 52945195 | 19177 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 4.7 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)N[C@@H](CO)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289676 | 19177 | None | 0 | Human | Functional | pKi | = | 8.6 | 8.6 | - | 0 | ChEMBL | 525 | 10 | 3 | 6 | 4.7 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)N[C@@H](CO)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11849871 | 188827 | None | 2 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 255 | 2 | 1 | 5 | 1.6 | CCCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 11849871 | 188827 | None | 2 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 255 | 2 | 1 | 5 | 1.6 | CCCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 11849871 | 188827 | None | 2 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 255 | 2 | 1 | 5 | 1.6 | CCCn1c(Br)nc2c(N)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL506450 | 188827 | None | 2 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 255 | 2 | 1 | 5 | 1.6 | CCCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL506450 | 188827 | None | 2 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 255 | 2 | 1 | 5 | 1.6 | CCCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL506450 | 188827 | None | 2 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 255 | 2 | 1 | 5 | 1.6 | CCCn1c(Br)nc2c(N)ncnc21 | 10.1039/C5MD00034C | |||
| 137636304 | 156199 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 419 | 4 | 2 | 7 | 3.4 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(C)(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4064207 | 156199 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 419 | 4 | 2 | 7 | 3.4 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(C)(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 137645935 | 157574 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 446 | 6 | 1 | 8 | 3.5 | COc1cnc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4080594 | 157574 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 446 | 6 | 1 | 8 | 3.5 | COc1cnc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 22002375 | 113218 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 258 | 2 | 2 | 7 | 0.3 | CNC(=O)c1cnc(N)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314875 | 113218 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 258 | 2 | 2 | 7 | 0.3 | CNC(=O)c1cnc(N)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 18440417 | 136659 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 362 | 7 | 2 | 7 | 3.7 | CCCn1c(-c2ccco2)nc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3740141 | 136659 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 362 | 7 | 2 | 7 | 3.7 | CCCn1c(-c2ccco2)nc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 118707867 | 113243 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 431 | 6 | 1 | 8 | 4.2 | CCOC(=O)c1cnc(NCc2ccc(C(F)(F)F)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314900 | 113243 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 431 | 6 | 1 | 8 | 4.2 | CCOC(=O)c1cnc(NCc2ccc(C(F)(F)F)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 52944930 | 19292 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 495 | 9 | 2 | 5 | 5.1 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290436 | 19292 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 495 | 9 | 2 | 5 | 5.1 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 459 | 2616 | None | 34 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm300323t | |||
| 477 | 2616 | None | 34 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm300323t | |||
| 5310960 | 2616 | None | 34 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm300323t | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm300323t | |||
| 20592013 | 94603 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 371 | 4 | 4 | 10 | -0.7 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL252198 | 94603 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 0 | ChEMBL | 371 | 4 | 4 | 10 | -0.7 | OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| 21874755 | 176890 | None | 1 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 336 | 4 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(C(=O)O)c3)c2n1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL461656 | 176890 | None | 1 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 336 | 4 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(C(=O)O)c3)c2n1 | 10.1016/j.ejmech.2010.04.039 | |||
| 71450241 | 82938 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 269 | 2 | 1 | 8 | 1.3 | CNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181147 | 82938 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 269 | 2 | 1 | 8 | 1.3 | CNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 71453892 | 82939 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181148 | 82939 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 24827444 | 96342 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 365 | 5 | 1 | 8 | 1.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4cccnc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL261526 | 96342 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 365 | 5 | 1 | 8 | 1.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4cccnc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 9870396 | 139035 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 494 | 7 | 1 | 7 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL378598 | 139035 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 494 | 7 | 1 | 7 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 21916394 | 160811 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 458 | 6 | 1 | 7 | 3.2 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL411452 | 160811 | None | 0 | Human | Functional | pKi | = | 7.7 | 7.7 | - | 0 | ChEMBL | 458 | 6 | 1 | 7 | 3.2 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL5074992 | 214348 | None | 0 | Human | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | None | None | None | CCCCn1c(=O)c2nc(C34CCC(C(=O)NCCOCCOCCN=[N+]=[N-])(CC3)CC4)[nH]c2n(CCCNC(=O)c2ccc(S(=O)(=O)F)cc2)c1=O | 10.1021/acs.jmedchem.0c02169 | |||||
| 9929470 | 110471 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm500752h | |||
| CHEMBL324735 | 110471 | None | 0 | Human | Functional | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm500752h | |||
| 118707859 | 113235 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 313 | 5 | 1 | 8 | 2.1 | CCOC(=O)c1cnc(NC2CC2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314892 | 113235 | None | 0 | Human | Functional | pKi | = | 5.7 | 5.7 | - | 0 | ChEMBL | 313 | 5 | 1 | 8 | 2.1 | CCOC(=O)c1cnc(NC2CC2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 158795 | 3768 | None | 33 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 2 | ChEMBL | 337 | 4 | 4 | 10 | -1.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1COCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 5592 | 3768 | None | 33 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 2 | ChEMBL | 337 | 4 | 4 | 10 | -1.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1COCC1 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL392149 | 3768 | None | 33 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 2 | ChEMBL | 337 | 4 | 4 | 10 | -1.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1COCC1 | 10.1016/j.bmc.2007.09.035 | |||
| DB04954 | 3768 | None | 33 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 2 | ChEMBL | 337 | 4 | 4 | 10 | -1.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1COCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 99619 | 203469 | None | 23 | Human | Functional | pKi | = | 4.6 | 4.6 | - | 0 | ChEMBL | 223 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCN)n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL66011 | 203469 | None | 23 | Human | Functional | pKi | = | 4.6 | 4.6 | - | 0 | ChEMBL | 223 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCN)n(C)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 101874280 | 113230 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 287 | 4 | 1 | 8 | 1.6 | CCOC(=O)c1cnc(NC)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314887 | 113230 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 287 | 4 | 1 | 8 | 1.6 | CCOC(=O)c1cnc(NC)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 22002319 | 113216 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 408 | 7 | 2 | 9 | 2.4 | CNC(=O)c1cnc(NCc2ccc(OC)c(OC)c2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314873 | 113216 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 408 | 7 | 2 | 9 | 2.4 | CNC(=O)c1cnc(NCc2ccc(OC)c(OC)c2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 1330 | 163216 | None | 45 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 3 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| CHEMBL418333 | 163216 | None | 45 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 3 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| CHEMBL435575 | 163216 | None | 45 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 3 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| 9887859 | 113510 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL118923 | 113510 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| CHEMBL332091 | 113510 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300323t | |||
| 76331702 | 103696 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 243 | 3 | 1 | 6 | 2.1 | CCCn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087706 | 103696 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 243 | 3 | 1 | 6 | 2.1 | CCCn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 76335304 | 103698 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 333 | 4 | 1 | 6 | 2.8 | Cn1c(-c2ccco2)nc2c(NC(=O)Cc3ccccc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087708 | 103698 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 333 | 4 | 1 | 6 | 2.8 | Cn1c(-c2ccco2)nc2c(NC(=O)Cc3ccccc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 118707862 | 113238 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 363 | 6 | 1 | 8 | 3.2 | CCOC(=O)c1cnc(NCc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314895 | 113238 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 363 | 6 | 1 | 8 | 3.2 | CCOC(=O)c1cnc(NCc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 76331702 | 103696 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 243 | 3 | 1 | 6 | 2.1 | CCCn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3087706 | 103696 | None | 0 | Human | Functional | pKi | = | 6.6 | 6.6 | - | 0 | ChEMBL | 243 | 3 | 1 | 6 | 2.1 | CCCn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1039/C5MD00034C | |||
| 11587927 | 162671 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 327 | 3 | 1 | 5 | 4.0 | Cn1c(-c2cccc(Cl)c2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4170180 | 162671 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 327 | 3 | 1 | 5 | 4.0 | Cn1c(-c2cccc(Cl)c2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL5089483 | 215207 | None | 0 | Human | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | None | None | None | CCCCn1c(=O)c2nc(C34CCC(C(=O)NCCCCN=[N+]=[N-])(CC3)CC4)[nH]c2n(CCCNC(=O)c2ccc(S(=O)(=O)F)cc2)c1=O | 10.1021/acs.jmedchem.0c02169 | |||||
| 9936058 | 59556 | None | 2 | Human | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | 508 | 9 | 2 | 9 | 1.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NN4C(=O)C(C)=C(C)C4=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17173 | 59556 | None | 2 | Human | Functional | pKi | = | 7.6 | 7.6 | - | 0 | ChEMBL | 508 | 9 | 2 | 9 | 1.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NN4C(=O)C(C)=C(C)C4=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 377 | 2756 | None | 53 | Rat | Functional | pKi | = | 5.6 | 5.6 | - | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9802822 | |||
| 425 | 2756 | None | 53 | Rat | Functional | pKi | = | 5.6 | 5.6 | - | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9802822 | |||
| 448222 | 2756 | None | 53 | Rat | Functional | pKi | = | 5.6 | 5.6 | - | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9802822 | |||
| CHEMBL464859 | 2756 | None | 53 | Rat | Functional | pKi | = | 5.6 | 5.6 | - | 10 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm9802822 | |||
| 71462773 | 82943 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 311 | 4 | 1 | 8 | 2.5 | CC[C@H](C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181151 | 82943 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 311 | 4 | 1 | 8 | 2.5 | CC[C@H](C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 71457391 | 82924 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 379 | 4 | 1 | 8 | 3.5 | Cn1cc2c(nc(NCc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2180935 | 82924 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 379 | 4 | 1 | 8 | 3.5 | Cn1cc2c(nc(NCc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 71457407 | 82952 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 323 | 3 | 1 | 8 | 2.6 | Cn1cc2c(nc(NC3CCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181160 | 82952 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 323 | 3 | 1 | 8 | 2.6 | Cn1cc2c(nc(NC3CCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 52942475 | 19252 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 489 | 9 | 2 | 5 | 5.7 | CC(C)CCc1c(-c2nccs2)c(=O)[nH]c2ccc(OCC(=O)NC(C)(C)c3ccccc3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290212 | 19252 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 489 | 9 | 2 | 5 | 5.7 | CC(C)CCc1c(-c2nccs2)c(=O)[nH]c2ccc(OCC(=O)NC(C)(C)c3ccccc3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| 42636897 | 172638 | None | 25 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 379 | 4 | 3 | 8 | 1.3 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CC5CCC4C5)ncnc32)[C@@H]1O | 10.1021/jm801456g | |||
| CHEMBL449575 | 172638 | None | 25 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 379 | 4 | 3 | 8 | 1.3 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CC5CCC4C5)ncnc32)[C@@H]1O | 10.1021/jm801456g | |||
| 76331703 | 103702 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 453 | 7 | 1 | 7 | 4.7 | Cc1ccc(COc2ccc(CC(=O)Nc3ncnc4c3nc(-c3ccco3)n4C)cc2)cc1 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087712 | 103702 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 453 | 7 | 1 | 7 | 4.7 | Cc1ccc(COc2ccc(CC(=O)Nc3ncnc4c3nc(-c3ccco3)n4C)cc2)cc1 | 10.1016/j.ejmech.2013.10.006 | |||
| 71462755 | 82929 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Cn1cc2c(nc(NCCc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2180940 | 82929 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Cn1cc2c(nc(NCCc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 44572469 | 179449 | None | 11 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 257 | 2 | 2 | 6 | 0.2 | Nc1ncnc2c1nc(Br)n2CCO | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL474058 | 179449 | None | 11 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 257 | 2 | 2 | 6 | 0.2 | Nc1ncnc2c1nc(Br)n2CCO | 10.1016/j.ejmech.2010.04.039 | |||
| 44572469 | 179449 | None | 11 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 257 | 2 | 2 | 6 | 0.2 | Nc1ncnc2c1nc(Br)n2CCO | 10.1016/j.bmc.2009.02.030 | |||
| 44572469 | 179449 | None | 11 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 257 | 2 | 2 | 6 | 0.2 | Nc1ncnc2c1nc(Br)n2CCO | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL474058 | 179449 | None | 11 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 257 | 2 | 2 | 6 | 0.2 | Nc1ncnc2c1nc(Br)n2CCO | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL474058 | 179449 | None | 11 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 257 | 2 | 2 | 6 | 0.2 | Nc1ncnc2c1nc(Br)n2CCO | 10.1016/j.ejmech.2013.10.006 | |||
| 24882472 | 154652 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 456 | 5 | 4 | 10 | 1.4 | CNC(=S)OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL399514 | 154652 | None | 0 | Human | Functional | pKi | = | 5.6 | 5.6 | - | 0 | ChEMBL | 456 | 5 | 4 | 10 | 1.4 | CNC(=S)OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| 71459268 | 82932 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 398 | 5 | 2 | 8 | 3.4 | Cn1cc2c(nc(NCCc3c[nH]c4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181141 | 82932 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 398 | 5 | 2 | 8 | 3.4 | Cn1cc2c(nc(NCCc3c[nH]c4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 9806649 | 59541 | None | 0 | Human | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 518 | 10 | 3 | 8 | 2.8 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(=O)NC)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17167 | 59541 | None | 0 | Human | Functional | pKi | = | 8.5 | 8.5 | - | 0 | ChEMBL | 518 | 10 | 3 | 8 | 2.8 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(=O)NC)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 11605883 | 79950 | None | 6 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL212625 | 79950 | None | 6 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 9892149 | 59623 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 499 | 9 | 2 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(/C=C/C(=O)Nc4ccccc4C(C)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17202 | 59623 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 499 | 9 | 2 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(/C=C/C(=O)Nc4ccccc4C(C)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 541759 | 170033 | None | 1 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 477 | 9 | 3 | 8 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(O)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL444281 | 170033 | None | 1 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 477 | 9 | 3 | 8 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(O)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 9936467 | 58090 | None | 1 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 519 | 10 | 2 | 9 | 3.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(=O)OC)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16741 | 58090 | None | 1 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 519 | 10 | 2 | 9 | 3.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(=O)OC)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 155544096 | 173304 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 440 | 8 | 2 | 10 | 3.4 | Cn1cc2c(nc(NCCCCCNC(=O)OC(C)(C)C)n3nc(-c4ccco4)nc23)n1 | 10.1039/C9MD00014C | |||
| CHEMBL4526138 | 173304 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 440 | 8 | 2 | 10 | 3.4 | Cn1cc2c(nc(NCCCCCNC(=O)OC(C)(C)C)n3nc(-c4ccco4)nc23)n1 | 10.1039/C9MD00014C | |||
| 11053743 | 162876 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 239 | 2 | 1 | 5 | 2.1 | CCn1c(-c2ccccc2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4173347 | 162876 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 239 | 2 | 1 | 5 | 2.1 | CCn1c(-c2ccccc2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 118707855 | 113231 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 301 | 5 | 1 | 8 | 2.0 | CCNc1ncc(C(=O)OCC)c2nc(-c3ccco3)nn12 | 10.1021/jm500752h | |||
| CHEMBL3314888 | 113231 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 301 | 5 | 1 | 8 | 2.0 | CCNc1ncc(C(=O)OCC)c2nc(-c3ccco3)nn12 | 10.1021/jm500752h | |||
| 44447534 | 94979 | None | 0 | Human | Functional | pKi | = | 4.5 | 4.5 | - | 0 | ChEMBL | 442 | 5 | 4 | 11 | 0.0 | CNC(=O)OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL254693 | 94979 | None | 0 | Human | Functional | pKi | = | 4.5 | 4.5 | - | 0 | ChEMBL | 442 | 5 | 4 | 11 | 0.0 | CNC(=O)OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCOC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| 136199393 | 19235 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | 521 | 9 | 2 | 5 | 5.7 | Cc1cc(-c2c(CCc3ccccc3)c3cc(OCC(=O)NC(C)(C)c4ccccc4)ccc3[nH]c2=O)on1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290102 | 19235 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | 521 | 9 | 2 | 5 | 5.7 | Cc1cc(-c2c(CCc3ccccc3)c3cc(OCC(=O)NC(C)(C)c4ccccc4)ccc3[nH]c2=O)on1 | 10.1016/j.bmcl.2010.10.030 | |||
| 52947452 | 19310 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 558 | 9 | 2 | 5 | 4.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290543 | 19310 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 558 | 9 | 2 | 5 | 4.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 71461028 | 82925 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 363 | 4 | 1 | 8 | 3.0 | Cn1cc2c(nc(NCc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2180936 | 82925 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 363 | 4 | 1 | 8 | 3.0 | Cn1cc2c(nc(NCc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 127038355 | 136706 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 359 | 6 | 1 | 5 | 3.7 | CCCn1c(Br)nc2c(NCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3740619 | 136706 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 359 | 6 | 1 | 5 | 3.7 | CCCn1c(Br)nc2c(NCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 52941244 | 19249 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290209 | 19249 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 14426726 | 181635 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 353 | 4 | 3 | 8 | 1.0 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@@H]1O | 10.1021/jm801456g | |||
| CHEMBL477444 | 181635 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 353 | 4 | 3 | 8 | 1.0 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@@H]1O | 10.1021/jm801456g | |||
| 9807634 | 59882 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | 551 | 11 | 2 | 7 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NC(c4ccccc4)c4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17299 | 59882 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | 551 | 11 | 2 | 7 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NC(c4ccccc4)c4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 52950027 | 19141 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.3 | O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289461 | 19141 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.3 | O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 71453874 | 82919 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 345 | 4 | 1 | 8 | 2.9 | Cn1cc2c(nc(NCc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2180930 | 82919 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 345 | 4 | 1 | 8 | 2.9 | Cn1cc2c(nc(NCc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 2519 | 778 | None | 86 | Human | Functional | pKi | = | 4.5 | 4.5 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2021.113907 | |||
| 407 | 778 | None | 86 | Human | Functional | pKi | = | 4.5 | 4.5 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2021.113907 | |||
| 463 | 778 | None | 86 | Human | Functional | pKi | = | 4.5 | 4.5 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL113 | 778 | None | 86 | Human | Functional | pKi | = | 4.5 | 4.5 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2021.113907 | |||
| DB00201 | 778 | None | 86 | Human | Functional | pKi | = | 4.5 | 4.5 | -17378 | 8 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2021.113907 | |||
| 52950028 | 19142 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 461 | 7 | 2 | 5 | 4.7 | CC(C)(C)NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289462 | 19142 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 461 | 7 | 2 | 5 | 4.7 | CC(C)(C)NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11623934 | 162048 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 321 | 5 | 1 | 5 | 4.3 | CCCn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4160264 | 162048 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 321 | 5 | 1 | 5 | 4.3 | CCCn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 52941597 | 19090 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 357 | 5 | 1 | 4 | 2.7 | COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289109 | 19090 | None | 0 | Human | Functional | pKi | = | 5.5 | 5.5 | - | 0 | ChEMBL | 357 | 5 | 1 | 4 | 2.7 | COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL5092788 | 215387 | None | 0 | Human | Functional | pKi | = | 7.5 | 7.5 | - | 0 | ChEMBL | None | None | None | C#CCCCCNC(=O)C12CCC(c3nc4c(=O)n(CCCC)c(=O)n(CCCNC(=O)c5ccc(S(=O)(=O)F)cc5)c4[nH]3)(CC1)CC2 | 10.1021/acs.jmedchem.0c02169 | |||||
| 76335303 | 103697 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 259 | 4 | 2 | 7 | 1.1 | Nc1ncnc2c1nc(-c1ccco1)n2CCCO | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087707 | 103697 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 259 | 4 | 2 | 7 | 1.1 | Nc1ncnc2c1nc(-c1ccco1)n2CCCO | 10.1016/j.ejmech.2013.10.006 | |||
| 52945098 | 19351 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 504 | 9 | 1 | 6 | 3.4 | Cn1c(=O)c(S(C)(=O)=O)c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccccc3)ccc21 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290782 | 19351 | None | 0 | Human | Functional | pKi | = | 6.5 | 6.5 | - | 0 | ChEMBL | 504 | 9 | 1 | 6 | 3.4 | Cn1c(=O)c(S(C)(=O)=O)c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccccc3)ccc21 | 10.1016/j.bmcl.2010.10.030 | |||
| 145987819 | 167152 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 363 | 5 | 1 | 8 | 3.3 | CNc1ncc(C(=O)OC(C)c2ccccc2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| CHEMBL4290842 | 167152 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 363 | 5 | 1 | 8 | 3.3 | CNc1ncc(C(=O)OC(C)c2ccccc2)c2nc(-c3ccco3)nn12 | 10.1016/j.ejmech.2018.08.042 | |||
| 11492857 | 162349 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 279 | 3 | 1 | 5 | 3.0 | Cn1c(-c2ccccc2)nc2c(NC3CCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4165013 | 162349 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 279 | 3 | 1 | 5 | 3.0 | Cn1c(-c2ccccc2)nc2c(NC3CCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 11229946 | 103705 | None | 1 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 229 | 2 | 1 | 6 | 1.7 | CCn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087715 | 103705 | None | 1 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 229 | 2 | 1 | 6 | 1.7 | CCn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 71457405 | 82942 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 311 | 4 | 1 | 8 | 2.5 | CCC(C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181150 | 82942 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 311 | 4 | 1 | 8 | 2.5 | CCC(C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 71455619 | 82930 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 419 | 7 | 1 | 10 | 2.9 | COc1ccc(CCNc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1OC | 10.1021/jm300899q | |||
| CHEMBL2181139 | 82930 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 419 | 7 | 1 | 10 | 2.9 | COc1ccc(CCNc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1OC | 10.1021/jm300899q | |||
| 10085373 | 10426 | None | 6 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 286 | 2 | 1 | 6 | 0.6 | COc1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL11635 | 10426 | None | 6 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 286 | 2 | 1 | 6 | 0.6 | COc1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1016/j.ejmech.2010.04.039 | |||
| 71455603 | 82922 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.2 | Cc1ccc(CNc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm300899q | |||
| CHEMBL2180933 | 82922 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.2 | Cc1ccc(CNc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm300899q | |||
| 71455622 | 82945 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 325 | 6 | 1 | 8 | 2.9 | CCCCCNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181153 | 82945 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 325 | 6 | 1 | 8 | 2.9 | CCCCCNc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 57429649 | 158940 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4095843 | 158940 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| 66892867 | 156317 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 479 | 7 | 1 | 8 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4065629 | 156317 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 479 | 7 | 1 | 8 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 57429649 | 158940 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4095843 | 158940 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11690712 | 77790 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 439 | 7 | 3 | 6 | 2.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCc4ccccc4)cc3)nc2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL209230 | 77790 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 439 | 7 | 3 | 6 | 2.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCc4ccccc4)cc3)nc2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 52946453 | 19221 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 521 | 9 | 2 | 5 | 5.6 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290001 | 19221 | None | 0 | Human | Functional | pKi | = | 8.4 | 8.4 | - | 0 | ChEMBL | 521 | 9 | 2 | 5 | 5.6 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.10.030 | |||
| 44404010 | 72575 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 480 | 9 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| CHEMBL199249 | 72575 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 480 | 9 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| 135528632 | 72561 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 329 | 5 | 2 | 7 | 1.5 | CCCn1c(=O)c2nc(-c3ccc(O)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| CHEMBL199196 | 72561 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 329 | 5 | 2 | 7 | 1.5 | CCCn1c(=O)c2nc(-c3ccc(O)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| 9870719 | 57415 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4cccc(C(C)=O)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16534 | 57415 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4cccc(C(C)=O)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 126079 | 4098 | None | 31 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm990421v | |||
| 451 | 4098 | None | 31 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm990421v | |||
| CHEMBL27041 | 4098 | None | 31 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm990421v | |||
| 52950027 | 19141 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.3 | O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289461 | 19141 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 478 | 9 | 2 | 4 | 5.3 | O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 52950000 | 19124 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 505 | 8 | 2 | 4 | 5.2 | N#Cc1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289344 | 19124 | None | 0 | Human | Functional | pKi | = | 6.4 | 6.4 | - | 0 | ChEMBL | 505 | 8 | 2 | 4 | 5.2 | N#Cc1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 52948915 | 19293 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 541 | 9 | 2 | 5 | 6.0 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290437 | 19293 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 541 | 9 | 2 | 5 | 6.0 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 44572409 | 189689 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 267 | 1 | 1 | 5 | 1.9 | Nc1ncnc2c1nc(Br)n2C1CCC1 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL515419 | 189689 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 267 | 1 | 1 | 5 | 1.9 | Nc1ncnc2c1nc(Br)n2C1CCC1 | 10.1016/j.bmc.2009.02.030 | |||
| 123807 | 870 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | -12022 | 7 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 374 | 870 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | -12022 | 7 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 379 | 870 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | -12022 | 7 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL284969 | 870 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | -12022 | 7 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 176407 | 4146 | None | 84 | Human | Functional | pKi | = | 7.4 | 7.4 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm900718w | |||
| 405 | 4146 | None | 84 | Human | Functional | pKi | = | 7.4 | 7.4 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm900718w | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Functional | pKi | = | 7.4 | 7.4 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm900718w | |||
| DB08770 | 4146 | None | 84 | Human | Functional | pKi | = | 7.4 | 7.4 | -13 | 2 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm900718w | |||
| 44572355 | 179582 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 269 | 2 | 1 | 5 | 1.8 | CC(C)Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL474207 | 179582 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 269 | 2 | 1 | 5 | 1.8 | CC(C)Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2010.04.039 | |||
| 44572355 | 179582 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 269 | 2 | 1 | 5 | 1.8 | CC(C)Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL474207 | 179582 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 269 | 2 | 1 | 5 | 1.8 | CC(C)Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 380 | 1286 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 5 | ChEMBL | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 657378 | 1286 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 5 | ChEMBL | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL68738 | 1286 | None | 54 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 5 | ChEMBL | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10.1016/j.bmc.2007.09.035 | |||
| 9915751 | 59127 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 557 | 14 | 1 | 11 | 1.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(CC(=O)OCC)CC(=O)OCC)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL16984 | 59127 | None | 0 | Human | Functional | pKi | = | 7.4 | 7.4 | - | 0 | ChEMBL | 557 | 14 | 1 | 11 | 1.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(CC(=O)OCC)CC(=O)OCC)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 44447542 | 154788 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 351 | 4 | 4 | 10 | -1.0 | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N[C@@H]3CCOC3)ncnc21 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL400190 | 154788 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 351 | 4 | 4 | 10 | -1.0 | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N[C@@H]3CCOC3)ncnc21 | 10.1016/j.bmc.2007.09.035 | |||
| 44447548 | 154884 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 385 | 4 | 4 | 10 | -0.3 | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N[C@@H]3CCOC3)nc(Cl)nc21 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL400782 | 154884 | None | 0 | Human | Functional | pKi | = | 5.4 | 5.4 | - | 0 | ChEMBL | 385 | 4 | 4 | 10 | -0.3 | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N[C@@H]3CCOC3)nc(Cl)nc21 | 10.1016/j.bmc.2007.09.035 | |||
| 44572408 | 188858 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 253 | 2 | 1 | 5 | 1.4 | C=CCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL506888 | 188858 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 253 | 2 | 1 | 5 | 1.4 | C=CCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 127042409 | 136772 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 348 | 6 | 2 | 7 | 3.7 | CCCn1c(-c2ccco2)nc2c(N)nc(NCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3741217 | 136772 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 348 | 6 | 2 | 7 | 3.7 | CCCn1c(-c2ccco2)nc2c(N)nc(NCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 118707860 | 113236 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 341 | 5 | 1 | 8 | 2.9 | CCOC(=O)c1cnc(NC2CCCC2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314893 | 113236 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 341 | 5 | 1 | 8 | 2.9 | CCOC(=O)c1cnc(NC2CCCC2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 9912946 | 59000 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 478 | 7 | 2 | 6 | 3.7 | O=C(O)/C=C/c1ccc(-c2nc3c(=O)n(Cc4ccccc4)c(=O)n(Cc4ccccc4)c3[nH]2)cc1 | 10.1021/jm990421v | |||
| CHEMBL16908 | 59000 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 478 | 7 | 2 | 6 | 3.7 | O=C(O)/C=C/c1ccc(-c2nc3c(=O)n(Cc4ccccc4)c(=O)n(Cc4ccccc4)c3[nH]2)cc1 | 10.1021/jm990421v | |||
| 76335305 | 103707 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 245 | 3 | 2 | 7 | 0.7 | Nc1ncnc2c1nc(-c1ccco1)n2CCO | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087717 | 103707 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 245 | 3 | 2 | 7 | 0.7 | Nc1ncnc2c1nc(-c1ccco1)n2CCO | 10.1016/j.ejmech.2013.10.006 | |||
| 10387088 | 59454 | None | 0 | Human | Functional | pKi | = | 7.3 | 7.3 | - | 0 | ChEMBL | 414 | 10 | 2 | 7 | 2.6 | CCCCn1c(=O)c2nc(-c3ccc(OCC(=O)O)cc3)[nH]c2n(CCCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL17123 | 59454 | None | 0 | Human | Functional | pKi | = | 7.3 | 7.3 | - | 0 | ChEMBL | 414 | 10 | 2 | 7 | 2.6 | CCCCn1c(=O)c2nc(-c3ccc(OCC(=O)O)cc3)[nH]c2n(CCCC)c1=O | 10.1021/jm990421v | |||
| 71455621 | 82944 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 311 | 4 | 1 | 8 | 2.5 | CC[C@@H](C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181152 | 82944 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 311 | 4 | 1 | 8 | 2.5 | CC[C@@H](C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 118707864 | 113240 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 393 | 7 | 1 | 9 | 3.2 | CCOC(=O)c1cnc(NCc2ccc(OC)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314897 | 113240 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 393 | 7 | 1 | 9 | 3.2 | CCOC(=O)c1cnc(NCc2ccc(OC)cc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 44582613 | 181636 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 387 | 4 | 3 | 8 | 1.7 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@@H]1O | 10.1021/jm801456g | |||
| CHEMBL477445 | 181636 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 387 | 4 | 3 | 8 | 1.7 | O[C@@H]1[C@@H](CCl)O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@@H]1O | 10.1021/jm801456g | |||
| 118707847 | 113222 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 376 | 5 | 2 | 7 | 1.9 | CNC(=O)c1cnc(NC(=O)Cc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314879 | 113222 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 376 | 5 | 2 | 7 | 1.9 | CNC(=O)c1cnc(NC(=O)Cc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 21958762 | 155778 | None | 0 | Human | Functional | pKi | = | 7.3 | 7.3 | - | 0 | ChEMBL | 288 | 4 | 2 | 6 | 0.7 | CCCn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL405901 | 155778 | None | 0 | Human | Functional | pKi | = | 7.3 | 7.3 | - | 0 | ChEMBL | 288 | 4 | 2 | 6 | 0.7 | CCCn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 10021483 | 186881 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 361 | 4 | 4 | 9 | 0.0 | OC[C@H]1O[C@@H](n2cnc3c(NC4CC5CCC4C5)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm801456g | |||
| CHEMBL489640 | 186881 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 361 | 4 | 4 | 9 | 0.0 | OC[C@H]1O[C@@H](n2cnc3c(NC4CC5CCC4C5)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm801456g | |||
| 50925499 | 19234 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 523 | 9 | 2 | 5 | 5.9 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290101 | 19234 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 523 | 9 | 2 | 5 | 5.9 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 10648228 | 98433 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 475 | 9 | 1 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(C)c4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL275606 | 98433 | None | 0 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 0 | ChEMBL | 475 | 9 | 1 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(C)c4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 135484064 | 2614 | None | 4 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm049418o | |||
| 390 | 2614 | None | 4 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm049418o | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm049418o | |||
| 135484064 | 2614 | None | 4 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2010.04.039 | |||
| 390 | 2614 | None | 4 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Functional | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2010.04.039 | |||
| 52942359 | 19192 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 517 | 9 | 2 | 4 | 5.8 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3ccccn3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289778 | 19192 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 517 | 9 | 2 | 4 | 5.8 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3ccccn3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 76313600 | 103701 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 439 | 7 | 1 | 7 | 4.4 | Cn1c(-c2ccco2)nc2c(NC(=O)Cc3ccc(OCc4ccccc4)cc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087711 | 103701 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 439 | 7 | 1 | 7 | 4.4 | Cn1c(-c2ccco2)nc2c(NC(=O)Cc3ccc(OCc4ccccc4)cc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 44572471 | 180605 | None | 2 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 271 | 3 | 2 | 6 | 0.6 | Nc1ncnc2c1nc(Br)n2CCCO | 10.1016/j.bmc.2009.02.030 | |||
| 44572471 | 180605 | None | 2 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 271 | 3 | 2 | 6 | 0.6 | Nc1ncnc2c1nc(Br)n2CCCO | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL475455 | 180605 | None | 2 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 271 | 3 | 2 | 6 | 0.6 | Nc1ncnc2c1nc(Br)n2CCCO | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL475455 | 180605 | None | 2 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 271 | 3 | 2 | 6 | 0.6 | Nc1ncnc2c1nc(Br)n2CCCO | 10.1016/j.ejmech.2013.10.006 | |||
| 52942501 | 19270 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 515 | 8 | 2 | 5 | 5.6 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCC(F)(F)F)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290324 | 19270 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 515 | 8 | 2 | 5 | 5.6 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCC(F)(F)F)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 71455620 | 82931 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 387 | 6 | 1 | 8 | 3.7 | CC(CCc1ccccc1)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181140 | 82931 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 387 | 6 | 1 | 8 | 3.7 | CC(CCc1ccccc1)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 71452056 | 82920 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.4 | C[C@H](Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12)c1ccccc1 | 10.1039/d0md00380h | |||
| CHEMBL2180931 | 82920 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.4 | C[C@H](Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12)c1ccccc1 | 10.1039/d0md00380h | |||
| 71452056 | 82920 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.4 | C[C@H](Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12)c1ccccc1 | 10.1021/jm300899q | |||
| CHEMBL2180931 | 82920 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 359 | 4 | 1 | 8 | 3.4 | C[C@H](Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12)c1ccccc1 | 10.1021/jm300899q | |||
| 11602451 | 162251 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 335 | 5 | 1 | 5 | 4.6 | CCCn1c(-c2ccccc2)nc2c(NC3CCCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4163601 | 162251 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 335 | 5 | 1 | 5 | 4.6 | CCCn1c(-c2ccccc2)nc2c(NC3CCCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 118707844 | 113101 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 348 | 5 | 2 | 7 | 1.9 | Nc1ncc(C(=O)NCCc2ccccc2)c2nc(-c3ccco3)nn12 | 10.1021/jm500752h | |||
| CHEMBL3313941 | 113101 | None | 0 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 348 | 5 | 2 | 7 | 1.9 | Nc1ncc(C(=O)NCCc2ccccc2)c2nc(-c3ccco3)nn12 | 10.1021/jm500752h | |||
| 136414902 | 159712 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 560 | 9 | 1 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4104450 | 159712 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 560 | 9 | 1 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 1329 | 1471 | None | 86 | Human | Functional | pKi | = | 7.3 | 7.3 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.ejmech.2010.04.039 | |||
| 386 | 1471 | None | 86 | Human | Functional | pKi | = | 7.3 | 7.3 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Functional | pKi | = | 7.3 | 7.3 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.ejmech.2010.04.039 | |||
| DB12946 | 1471 | None | 86 | Human | Functional | pKi | = | 7.3 | 7.3 | -9 | 8 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.ejmech.2010.04.039 | |||
| 52933926 | 156180 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 353 | 5 | 1 | 6 | 3.7 | CCCn1c(Oc2cccnc2C)nc2nc(C3CCCC3)[nH]c2c1=O | 10.1016/j.bmc.2017.02.029 | |||
| CHEMBL4063997 | 156180 | None | 0 | Human | Functional | pKi | = | 6.3 | 6.3 | - | 0 | ChEMBL | 353 | 5 | 1 | 6 | 3.7 | CCCn1c(Oc2cccnc2C)nc2nc(C3CCCC3)[nH]c2c1=O | 10.1016/j.bmc.2017.02.029 | |||
| 11608719 | 188740 | None | 24 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 269 | 3 | 1 | 5 | 2.0 | CCCCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL505089 | 188740 | None | 24 | Human | Functional | pKi | = | 5.3 | 5.3 | - | 0 | ChEMBL | 269 | 3 | 1 | 5 | 2.0 | CCCCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 11623708 | 162501 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 307 | 4 | 1 | 5 | 3.9 | CCn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4167491 | 162501 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 307 | 4 | 1 | 5 | 3.9 | CCn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 11774068 | 94562 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 404 | 4 | 2 | 6 | 2.4 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL251876 | 94562 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 404 | 4 | 2 | 6 | 2.4 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 10158974 | 155504 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 418 | 5 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL404168 | 155504 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 418 | 5 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.05.035 | |||
| CHEMBL5076192 | 214417 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | None | None | None | CCCCn1c(=O)c2nc(C34CCC(C(=O)NCCCCCCCCN=[N+]=[N-])(CC3)CC4)[nH]c2n(CCCNC(=O)c2ccc(S(=O)(=O)F)cc2)c1=O | 10.1021/acs.jmedchem.0c02169 | |||||
| 443 | 754 | None | 10 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10.1021/jm990421v | |||
| 6439089 | 754 | None | 10 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10.1021/jm990421v | |||
| CHEMBL16997 | 754 | None | 10 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10.1021/jm990421v | |||
| 52941244 | 19249 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290209 | 19249 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 118732285 | 118363 | None | 0 | Human | Functional | pKi | = | 4.2 | 4.2 | - | 0 | ChEMBL | 311 | 5 | 1 | 7 | 1.8 | CCOC(=O)c1nc(N)nc2nn(CCc3ccccc3)cc12 | 10.1016/j.ejmech.2015.01.046 | |||
| CHEMBL3410301 | 118363 | None | 0 | Human | Functional | pKi | = | 4.2 | 4.2 | - | 0 | ChEMBL | 311 | 5 | 1 | 7 | 1.8 | CCOC(=O)c1nc(N)nc2nn(CCc3ccccc3)cc12 | 10.1016/j.ejmech.2015.01.046 | |||
| 11681092 | 162709 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 307 | 3 | 1 | 5 | 3.7 | Cc1cccc(-c2nc3c(NC4CCCC4)ncnc3n2C)c1 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4170850 | 162709 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 307 | 3 | 1 | 5 | 3.7 | Cc1cccc(-c2nc3c(NC4CCCC4)ncnc3n2C)c1 | 10.1016/j.ejmech.2018.03.067 | |||
| 145991283 | 166844 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 364 | 6 | 2 | 9 | 3.0 | CCOC(=O)c1cnc(NNc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.08.042 | |||
| CHEMBL4285374 | 166844 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 364 | 6 | 2 | 9 | 3.0 | CCOC(=O)c1cnc(NNc2ccccc2)n2nc(-c3ccco3)nc12 | 10.1016/j.ejmech.2018.08.042 | |||
| 52944930 | 19292 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 495 | 9 | 2 | 5 | 5.1 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290436 | 19292 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 495 | 9 | 2 | 5 | 5.1 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 76324475 | 103703 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 334 | 3 | 2 | 6 | 3.3 | Cn1c(-c2ccco2)nc2c(NC(=O)Nc3ccccc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087713 | 103703 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 334 | 3 | 2 | 6 | 3.3 | Cn1c(-c2ccco2)nc2c(NC(=O)Nc3ccccc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 18440528 | 136630 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 388 | 7 | 2 | 6 | 3.6 | CCCn1c(Br)nc2c(N)nc(NCCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3739922 | 136630 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 388 | 7 | 2 | 6 | 3.6 | CCCn1c(Br)nc2c(N)nc(NCCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 71453894 | 82953 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 337 | 3 | 1 | 8 | 3.0 | Cn1cc2c(nc(NC3CCCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181161 | 82953 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 337 | 3 | 1 | 8 | 3.0 | Cn1cc2c(nc(NC3CCCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 52948671 | 19311 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 520 | 11 | 1 | 5 | 4.8 | COCCCNC(=O)COc1ccc2c(c1)c(CCc1ccccc1)c(-c1ccc(F)cc1F)c(=O)n2C | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290544 | 19311 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 520 | 11 | 1 | 5 | 4.8 | COCCCNC(=O)COc1ccc2c(c1)c(CCc1ccccc1)c(-c1ccc(F)cc1F)c(=O)n2C | 10.1016/j.bmcl.2010.10.030 | |||
| 44572473 | 180761 | None | 2 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 271 | 2 | 2 | 6 | 0.6 | CC(O)Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL475617 | 180761 | None | 2 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 271 | 2 | 2 | 6 | 0.6 | CC(O)Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 132941757 | 158897 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 460 | 7 | 1 | 7 | 4.4 | CCN(CC)C1CCC(C)(C(=O)Nc2nc3c(OC)ccc(N4CCOCC4)c3s2)CC1 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4095355 | 158897 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 460 | 7 | 1 | 7 | 4.4 | CCN(CC)C1CCC(C)(C(=O)Nc2nc3c(OC)ccc(N4CCOCC4)c3s2)CC1 | 10.1021/acs.jmedchem.6b01584 | |||
| 137631671 | 156331 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 352 | 5 | 1 | 5 | 3.9 | CCCn1c(-c2cccc(OC)c2)nc2nc(C3CCCC3)[nH]c2c1=O | 10.1016/j.bmc.2017.02.029 | |||
| CHEMBL4065762 | 156331 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 352 | 5 | 1 | 5 | 3.9 | CCCn1c(-c2cccc(OC)c2)nc2nc(C3CCCC3)[nH]c2c1=O | 10.1016/j.bmc.2017.02.029 | |||
| 71450242 | 82954 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 351 | 3 | 1 | 8 | 3.4 | Cn1cc2c(nc(NC3CCCCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181162 | 82954 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 351 | 3 | 1 | 8 | 3.4 | Cn1cc2c(nc(NC3CCCCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 52950000 | 19124 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 505 | 8 | 2 | 4 | 5.2 | N#Cc1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289344 | 19124 | None | 0 | Human | Functional | pKi | = | 6.2 | 6.2 | - | 0 | ChEMBL | 505 | 8 | 2 | 4 | 5.2 | N#Cc1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 52949755 | 19236 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 468 | 6 | 2 | 5 | 3.2 | Cc1c(S(C)(=O)=O)c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290103 | 19236 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 468 | 6 | 2 | 5 | 3.2 | Cc1c(S(C)(=O)=O)c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| 52948949 | 19268 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 494 | 8 | 3 | 4 | 5.4 | O=C(NCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290322 | 19268 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 494 | 8 | 3 | 4 | 5.4 | O=C(NCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 10226014 | 94589 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL252048 | 94589 | None | 0 | Human | Functional | pKi | = | 8.2 | 8.2 | - | 0 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 52950040 | 19158 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 523 | 10 | 2 | 5 | 6.1 | CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289569 | 19158 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 523 | 10 | 2 | 5 | 6.1 | CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 404 | 4096 | None | 33 | Human | Functional | pKi | = | 8.1 | 8.1 | 1318 | 2 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm990421v | |||
| 432 | 4096 | None | 33 | Human | Functional | pKi | = | 8.1 | 8.1 | 1318 | 2 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm990421v | |||
| 5697 | 4096 | None | 33 | Human | Functional | pKi | = | 8.1 | 8.1 | 1318 | 2 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm990421v | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Functional | pKi | = | 8.1 | 8.1 | 1318 | 2 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm990421v | |||
| 9827467 | 98385 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 504 | 10 | 3 | 8 | 2.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(N)=O)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL275360 | 98385 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 504 | 10 | 3 | 8 | 2.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C(N)=O)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 135921140 | 11341 | None | 0 | Mouse | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 267 | 1 | 1 | 4 | 1.7 | Cn1c(-c2ccccc2)nc2c1C1=NCCN1C(=O)N2 | 10.1021/jm011093d | |||
| CHEMBL117962 | 11341 | None | 0 | Mouse | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 267 | 1 | 1 | 4 | 1.7 | Cn1c(-c2ccccc2)nc2c1C1=NCCN1C(=O)N2 | 10.1021/jm011093d | |||
| 52946114 | 19271 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 525 | 9 | 2 | 6 | 5.7 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290325 | 19271 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 525 | 9 | 2 | 6 | 5.7 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 69029783 | 156325 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 570 | 9 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4065717 | 156325 | None | 0 | Human | Functional | pKi | = | 7.2 | 7.2 | - | 0 | ChEMBL | 570 | 9 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 2773172 | 188775 | None | 12 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 287 | 3 | 3 | 7 | -0.5 | Nc1ncnc2c1nc(Br)n2CC(O)CO | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL505633 | 188775 | None | 12 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 287 | 3 | 3 | 7 | -0.5 | Nc1ncnc2c1nc(Br)n2CC(O)CO | 10.1016/j.bmc.2009.02.030 | |||
| 118707879 | 113255 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 329 | 6 | 1 | 8 | 2.6 | CCOC(=O)c1cnc(NCC(C)C)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| CHEMBL3314913 | 113255 | None | 0 | Human | Functional | pKi | = | 5.2 | 5.2 | - | 0 | ChEMBL | 329 | 6 | 1 | 8 | 2.6 | CCOC(=O)c1cnc(NCC(C)C)n2nc(-c3ccco3)nc12 | 10.1021/jm500752h | |||
| 822296 | 189111 | None | 18 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 227 | 0 | 1 | 5 | 0.7 | Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 822296 | 189111 | None | 18 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 227 | 0 | 1 | 5 | 0.7 | Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL510288 | 189111 | None | 18 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 227 | 0 | 1 | 5 | 0.7 | Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL510288 | 189111 | None | 18 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 227 | 0 | 1 | 5 | 0.7 | Cn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 71457403 | 82933 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 299 | 4 | 2 | 9 | 0.7 | Cn1cc2c(nc(NCCO)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181142 | 82933 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 299 | 4 | 2 | 9 | 0.7 | Cn1cc2c(nc(NCCO)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 127040410 | 136768 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 345 | 5 | 1 | 5 | 3.6 | CCCn1c(Br)nc2c(NCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3741167 | 136768 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 345 | 5 | 1 | 5 | 3.6 | CCCn1c(Br)nc2c(NCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 71455601 | 82907 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 375 | 6 | 1 | 9 | 2.8 | Cn1cc2c(nc(NCCOc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2180918 | 82907 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 375 | 6 | 1 | 9 | 2.8 | Cn1cc2c(nc(NCCOc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 71452072 | 82946 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 353 | 7 | 1 | 8 | 3.7 | CCCCCC(C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181154 | 82946 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 353 | 7 | 1 | 8 | 3.7 | CCCCCC(C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 11565780 | 162278 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 307 | 5 | 1 | 5 | 3.9 | CCCn1c(-c2ccccc2)nc2c(NC3CCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4164048 | 162278 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 307 | 5 | 1 | 5 | 3.9 | CCCn1c(-c2ccccc2)nc2c(NC3CCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 308531 | 165719 | None | 10 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 225 | 1 | 1 | 5 | 1.6 | Cn1c(-c2ccccc2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL424597 | 165719 | None | 10 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 225 | 1 | 1 | 5 | 1.6 | Cn1c(-c2ccccc2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 76324476 | 103706 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 215 | 1 | 1 | 6 | 1.2 | Cn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087716 | 103706 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 215 | 1 | 1 | 6 | 1.2 | Cn1c(-c2ccco2)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL5073669 | 214299 | None | 0 | Human | Functional | pKi | = | 7.1 | 7.1 | - | 0 | ChEMBL | None | None | None | CCCCn1c(=O)c2nc(C34CCC(C(=O)NCCCN=[N+]=[N-])(CC3)CC4)[nH]c2n(CCCNC(=O)c2ccc(S(=O)(=O)F)cc2)c1=O | 10.1021/acs.jmedchem.0c02169 | |||||
| 76309882 | 103700 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 409 | 5 | 1 | 6 | 4.4 | Cn1c(-c2ccco2)nc2c(NC(=O)C(c3ccccc3)c3ccccc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL3087710 | 103700 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 409 | 5 | 1 | 6 | 4.4 | Cn1c(-c2ccco2)nc2c(NC(=O)C(c3ccccc3)c3ccccc3)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 44236568 | 156468 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4067401 | 156468 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 69031481 | 157075 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4074253 | 157075 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| 57429602 | 157237 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4076435 | 157237 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| 69031481 | 157075 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4074253 | 157075 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 57429602 | 157237 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4076435 | 157237 | None | 0 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 72197883 | 90799 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 407 | 5 | 2 | 9 | 3.2 | CN(C)c1nc(N)nc(-c2sc(NC(=O)c3ccco3)nc2-c2ccccc2)n1 | 10.1016/j.ejmech.2013.03.020 | |||
| CHEMBL2391837 | 90799 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 407 | 5 | 2 | 9 | 3.2 | CN(C)c1nc(N)nc(-c2sc(NC(=O)c3ccco3)nc2-c2ccccc2)n1 | 10.1016/j.ejmech.2013.03.020 | |||
| 52946114 | 19271 | None | 0 | Human | Functional | pKi | = | 7.1 | 7.1 | - | 0 | ChEMBL | 525 | 9 | 2 | 6 | 5.7 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290325 | 19271 | None | 0 | Human | Functional | pKi | = | 7.1 | 7.1 | - | 0 | ChEMBL | 525 | 9 | 2 | 6 | 5.7 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 439176 | 98619 | None | 71 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 2 | ChEMBL | 297 | 3 | 3 | 9 | -0.6 | CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm031092g | |||
| CHEMBL277041 | 98619 | None | 71 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 2 | ChEMBL | 297 | 3 | 3 | 9 | -0.6 | CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm031092g | |||
| 127040064 | 136749 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 376 | 8 | 2 | 7 | 4.1 | CCCn1c(-c2ccco2)nc2c(N)nc(NCCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3740992 | 136749 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 376 | 8 | 2 | 7 | 4.1 | CCCn1c(-c2ccco2)nc2c(N)nc(NCCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 44447519 | 94884 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 440 | 5 | 4 | 10 | 1.2 | CNC(=O)OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL254064 | 94884 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 440 | 5 | 4 | 10 | 1.2 | CNC(=O)OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@](C)(O)[C@@H]1O | 10.1016/j.bmc.2007.09.035 | |||
| 25188209 | 178757 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 311 | 3 | 1 | 8 | 1.6 | Nc1nc(-c2ncco2)c2nnn(Cc3ccccc3F)c2n1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL468701 | 178757 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 311 | 3 | 1 | 8 | 1.6 | Nc1nc(-c2ncco2)c2nnn(Cc3ccccc3F)c2n1 | 10.1016/j.ejmech.2010.04.039 | |||
| 5248753 | 178751 | None | 6 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 241 | 1 | 1 | 5 | 1.2 | CCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| 5248753 | 178751 | None | 6 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 241 | 1 | 1 | 5 | 1.2 | CCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| CHEMBL468633 | 178751 | None | 6 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 241 | 1 | 1 | 5 | 1.2 | CCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL468633 | 178751 | None | 6 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 241 | 1 | 1 | 5 | 1.2 | CCn1c(Br)nc2c(N)ncnc21 | 10.1016/j.ejmech.2013.10.006 | |||
| 72197703 | 90795 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 347 | 4 | 1 | 5 | 4.7 | O=C(Nc1nc(-c2ccccc2)c(-c2ccccn2)s1)c1ccco1 | 10.1016/j.ejmech.2013.03.020 | |||
| CHEMBL2391833 | 90795 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 347 | 4 | 1 | 5 | 4.7 | O=C(Nc1nc(-c2ccccc2)c(-c2ccccn2)s1)c1ccco1 | 10.1016/j.ejmech.2013.03.020 | |||
| 71457389 | 82905 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 285 | 3 | 1 | 9 | 1.2 | CONc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2180916 | 82905 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 0 | ChEMBL | 285 | 3 | 1 | 9 | 1.2 | CONc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 11587409 | 162994 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 1 | ChEMBL | 293 | 3 | 1 | 5 | 3.4 | Cn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4175366 | 162994 | None | 0 | Human | Functional | pKi | = | 5.1 | 5.1 | - | 1 | ChEMBL | 293 | 3 | 1 | 5 | 3.4 | Cn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 12016633 | 172668 | None | 1 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 281 | 1 | 1 | 5 | 2.3 | Nc1ncnc2c1nc(Br)n2C1CCCC1 | 10.1016/j.bmc.2009.02.030 | |||
| CHEMBL449924 | 172668 | None | 1 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 281 | 1 | 1 | 5 | 2.3 | Nc1ncnc2c1nc(Br)n2C1CCCC1 | 10.1016/j.bmc.2009.02.030 | |||
| 9946338 | 154787 | None | 43 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 349 | 4 | 4 | 9 | 0.2 | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CCCC3)ncnc21 | 10.1016/j.bmc.2007.09.035 | |||
| CHEMBL400189 | 154787 | None | 43 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 349 | 4 | 4 | 9 | 0.2 | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC3CCCC3)ncnc21 | 10.1016/j.bmc.2007.09.035 | |||
| 52941201 | 19222 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 517 | 9 | 2 | 4 | 5.8 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3ccncc3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290002 | 19222 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 517 | 9 | 2 | 4 | 5.8 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3ccncc3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 10267860 | 176821 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 317 | 3 | 1 | 8 | 2.0 | N#Cc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL461007 | 176821 | None | 0 | Human | Functional | pKi | = | 6.1 | 6.1 | - | 0 | ChEMBL | 317 | 3 | 1 | 8 | 2.0 | N#Cc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1016/j.ejmech.2010.04.039 | |||
| 11198201 | 110675 | None | 7 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 327 | 5 | 2 | 6 | 2.0 | CCCn1c(=O)c2nc(-c3ccc(N)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| CHEMBL32598 | 110675 | None | 7 | Human | Functional | pKi | = | 8.1 | 8.1 | - | 0 | ChEMBL | 327 | 5 | 2 | 6 | 2.0 | CCCn1c(=O)c2nc(-c3ccc(N)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm049418o | |||
| 14484978 | 97590 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 483 | 9 | 1 | 10 | 1.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)ON4C(=O)CCC4=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL27081 | 97590 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 483 | 9 | 1 | 10 | 1.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)ON4C(=O)CCC4=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 9850900 | 98349 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 565 | 12 | 1 | 7 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(Cc4ccccc4)Cc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| CHEMBL275149 | 98349 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 565 | 12 | 1 | 7 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(Cc4ccccc4)Cc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm990421v | |||
| 9850900 | 98349 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 565 | 12 | 1 | 7 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(Cc4ccccc4)Cc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL275149 | 98349 | None | 0 | Human | Functional | pKi | = | 8.0 | 8.0 | - | 0 | ChEMBL | 565 | 12 | 1 | 7 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)N(Cc4ccccc4)Cc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.ejmech.2010.04.039 | |||
| 11508049 | 161980 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 321 | 4 | 1 | 5 | 4.3 | CCn1c(-c2ccccc2)nc2c(NC3CCCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4159165 | 161980 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 321 | 4 | 1 | 5 | 4.3 | CCn1c(-c2ccccc2)nc2c(NC3CCCCC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 2153 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm049418o | |||
| 2620 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm049418o | |||
| 413 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm049418o | |||
| CHEMBL190 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm049418o | |||
| DB00277 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm049418o | |||
| 2153 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2010.04.039 | |||
| 2620 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2010.04.039 | |||
| 413 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2010.04.039 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2010.04.039 | |||
| DB00277 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2010.04.039 | |||
| 2153 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2021.113907 | |||
| 2620 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2021.113907 | |||
| 413 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2021.113907 | |||
| DB00277 | 3798 | None | 115 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 5 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2021.113907 | |||
| 11681354 | 162934 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 323 | 5 | 1 | 6 | 3.1 | CCCn1c(-c2ccccc2)nc2c(NC3CCOC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| CHEMBL4174308 | 162934 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 323 | 5 | 1 | 6 | 3.1 | CCCn1c(-c2ccccc2)nc2c(NC3CCOC3)ncnc21 | 10.1016/j.ejmech.2018.03.067 | |||
| 72197701 | 90793 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 375 | 5 | 1 | 6 | 4.3 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccn2)s1)c1ccco1 | 10.1016/j.ejmech.2013.03.020 | |||
| CHEMBL2391831 | 90793 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 375 | 5 | 1 | 6 | 4.3 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccn2)s1)c1ccco1 | 10.1016/j.ejmech.2013.03.020 | |||
| 18440431 | 136642 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 296 | 6 | 2 | 6 | 2.5 | CCCn1cnc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL3739985 | 136642 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 296 | 6 | 2 | 6 | 2.5 | CCCn1cnc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 127042994 | 136786 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 347 | 7 | 1 | 6 | 4.2 | CCCn1c(-c2ccco2)nc2c(NCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL3741337 | 136786 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 347 | 7 | 1 | 6 | 4.2 | CCCn1c(-c2ccco2)nc2c(NCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 71453891 | 82934 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 313 | 5 | 2 | 9 | 1.1 | Cn1cc2c(nc(NCCCO)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181143 | 82934 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 313 | 5 | 2 | 9 | 1.1 | Cn1cc2c(nc(NCCCO)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL5088372 | 215153 | None | 0 | Human | Functional | pKi | = | 7.0 | 7.0 | - | 0 | ChEMBL | None | None | None | CCCCn1c(=O)c2nc(C34CCC(C(=O)NCCOCCOCCOCCN=[N+]=[N-])(CC3)CC4)[nH]c2n(CCCNC(=O)c2ccc(S(=O)(=O)F)cc2)c1=O | 10.1021/acs.jmedchem.0c02169 | |||||
| 71462775 | 82956 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 351 | 4 | 1 | 8 | 3.3 | Cn1cc2c(nc(NCC3CCCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| CHEMBL2181164 | 82956 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 351 | 4 | 1 | 8 | 3.3 | Cn1cc2c(nc(NCC3CCCCC3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm300899q | |||
| 71457404 | 82940 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 297 | 3 | 1 | 8 | 2.1 | CC(C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| CHEMBL2181149 | 82940 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 297 | 3 | 1 | 8 | 2.1 | CC(C)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm300899q | |||
| 71455604 | 82923 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 375 | 5 | 1 | 9 | 2.9 | COc1ccc(CNc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm300899q | |||
| CHEMBL2180934 | 82923 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 375 | 5 | 1 | 9 | 2.9 | COc1ccc(CNc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm300899q | |||
| 162657141 | 180921 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 371 | 6 | 2 | 11 | 0.6 | CCOC(=O)C(CO)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1039/d0md00380h | |||
| CHEMBL4757966 | 180921 | None | 0 | Human | Functional | pKi | = | 5.0 | 5.0 | - | 0 | ChEMBL | 371 | 6 | 2 | 11 | 0.6 | CCOC(=O)C(CO)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1039/d0md00380h | |||
| 2690 | 902 | None | 66 | Human | Functional | pA2 | = | 7.8 | 7.8 | -31 | 5 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 8937736 | |||
| 384 | 902 | None | 66 | Human | Functional | pA2 | = | 7.8 | 7.8 | -31 | 5 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 8937736 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Functional | pA2 | = | 7.8 | 7.8 | -31 | 5 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 8937736 | |||
| 404 | 4096 | None | 33 | Human | Functional | pA2 | = | 7.9 | 7.9 | 1318 | 2 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 8937736 | |||
| 432 | 4096 | None | 33 | Human | Functional | pA2 | = | 7.9 | 7.9 | 1318 | 2 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 8937736 | |||
| 5697 | 4096 | None | 33 | Human | Functional | pA2 | = | 7.9 | 7.9 | 1318 | 2 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 8937736 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Functional | pA2 | = | 7.9 | 7.9 | 1318 | 2 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 8937736 | |||
| 2844 | 283 | None | 107 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -16 | 5 | Drug Central | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 60961 | 283 | None | 107 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -16 | 5 | Drug Central | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 90 | 283 | None | 107 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -16 | 5 | Drug Central | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| CHEMBL477 | 283 | None | 107 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -16 | 5 | Drug Central | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| DB00640 | 283 | None | 107 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -16 | 5 | Drug Central | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 219024 | 3298 | None | 65 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -51 | 5 | Drug Central | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | None | |||
| 2362 | 3298 | None | 65 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -51 | 5 | Drug Central | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | None | |||
| 5596 | 3298 | None | 65 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -51 | 5 | Drug Central | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | None | |||
| CHEMBL317052 | 3298 | None | 65 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -51 | 5 | Drug Central | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | None | |||
| DB06213 | 3298 | None | 65 | Human | Functional | pEC50 | = | 8.3 | 8.3 | -51 | 5 | Drug Central | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | None | |||
| 11224 | 581 | None | 35 | Mouse | Functional | pIC50 | = | 6.4 | 6.4 | -6 | 7 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| 118016229 | 581 | None | 35 | Mouse | Functional | pIC50 | = | 6.4 | 6.4 | -6 | 7 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| CHEMBL4522981 | 581 | None | 35 | Mouse | Functional | pIC50 | = | 6.4 | 6.4 | -6 | 7 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| 11224 | 581 | None | 35 | Rat | Functional | pIC50 | = | 6.6 | 6.6 | -4 | 7 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| 118016229 | 581 | None | 35 | Rat | Functional | pIC50 | = | 6.6 | 6.6 | -4 | 7 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| CHEMBL4522981 | 581 | None | 35 | Rat | Functional | pIC50 | = | 6.6 | 6.6 | -4 | 7 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Activity | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
Reference ligand |
Vendors |
Species |
Assay Type |
Activity Type |
Activity Relation |
Activity Value |
p-value (-log) |
Fold selectivity |
Tested GPCRs |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
|
| 10981286 | 1917 | None | 30 | Human | Binding | pEC50 | = | 4 | 4.0 | -28183 | 4 | ChEMBL | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 10.1021/jm0109762 | |||
| 5599 | 1917 | None | 30 | Human | Binding | pEC50 | = | 4 | 4.0 | -28183 | 4 | ChEMBL | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 10.1021/jm0109762 | |||
| 5736 | 1917 | None | 30 | Human | Binding | pEC50 | = | 4 | 4.0 | -28183 | 4 | ChEMBL | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 10.1021/jm0109762 | |||
| CHEMBL260563 | 1917 | None | 30 | Human | Binding | pEC50 | = | 4 | 4.0 | -28183 | 4 | ChEMBL | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 10.1021/jm0109762 | |||
| 11014608 | 96357 | None | 0 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 389 | 6 | 4 | 9 | 0.8 | CCCCC#Cc1nc(NC(C)C)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/jm0109762 | |||
| CHEMBL261623 | 96357 | None | 0 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 389 | 6 | 4 | 9 | 0.8 | CCCCC#Cc1nc(NC(C)C)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/jm0109762 | |||
| 10020580 | 107971 | None | 5 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 5 | ChEMBL | 347 | 4 | 4 | 9 | -0.4 | CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/jm0109762 | |||
| CHEMBL319387 | 107971 | None | 5 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 5 | ChEMBL | 347 | 4 | 4 | 9 | -0.4 | CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/jm0109762 | |||
| 11112381 | 159439 | None | 0 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 411 | 4 | 5 | 10 | -0.4 | CNc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL410115 | 159439 | None | 0 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 411 | 4 | 5 | 10 | -0.4 | CNc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 10970819 | 168834 | None | 0 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 375 | 6 | 4 | 9 | 0.4 | CCCCC#Cc1nc(NCC)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/jm0109762 | |||
| CHEMBL437842 | 168834 | None | 0 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 375 | 6 | 4 | 9 | 0.4 | CCCCC#Cc1nc(NCC)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 | 10.1021/jm0109762 | |||
| 11068963 | 198119 | None | 1 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 381 | 3 | 4 | 9 | -0.1 | CNc1nc(C#Cc2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL574597 | 198119 | None | 1 | Human | Binding | pEC50 | = | 4 | 4.0 | - | 3 | ChEMBL | 381 | 3 | 4 | 9 | -0.1 | CNc1nc(C#Cc2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 9932840 | 77896 | None | 1 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 4 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#CC(O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm0109762 | |||
| CHEMBL2094083 | 77896 | None | 1 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 4 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#CC(O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm0109762 | |||
| 377 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.9 | 6.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b01662 | |||
| 425 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.9 | 6.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b01662 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.9 | 6.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b01662 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.9 | 6.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.8b01662 | |||
| 377 | 2756 | None | 53 | Human | Binding | pEC50 | = | 4.8 | 4.8 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| 425 | 2756 | None | 53 | Human | Binding | pEC50 | = | 4.8 | 4.8 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pEC50 | = | 4.8 | 4.8 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pEC50 | = | 4.8 | 4.8 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| 70682890 | 77812 | None | 5 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 3 | ChEMBL | 425 | 5 | 5 | 10 | -0.0 | CCNc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL2092788 | 77812 | None | 5 | Human | Binding | pEC50 | = | 5.8 | 5.8 | - | 3 | ChEMBL | 425 | 5 | 5 | 10 | -0.0 | CCNc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 23757284 | 85127 | None | 0 | Human | Binding | pEC50 | = | 6.7 | 6.7 | - | 3 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#C[C@@H](O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm0109762 | |||
| CHEMBL224874 | 85127 | None | 0 | Human | Binding | pEC50 | = | 6.7 | 6.7 | - | 3 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#C[C@@H](O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm0109762 | |||
| 25268841 | 8659 | None | 12 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 3 | ChEMBL | 402 | 5 | 1 | 7 | 2.6 | Nc1nc(-c2ccccc2)c2c(n1)-c1cc(OCCN3CCOCC3)ccc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||
| CHEMBL1095488 | 8659 | None | 12 | Human | Binding | pEC50 | = | 6.6 | 6.6 | - | 3 | ChEMBL | 402 | 5 | 1 | 7 | 2.6 | Nc1nc(-c2ccccc2)c2c(n1)-c1cc(OCCN3CCOCC3)ccc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||
| 13830108 | 77833 | None | 1 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 4 | ChEMBL | 397 | 3 | 5 | 10 | -0.9 | Nc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL2092941 | 77833 | None | 1 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 4 | ChEMBL | 397 | 3 | 5 | 10 | -0.9 | Nc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 23900137 | 95763 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#C[C@H](O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm0109762 | |||
| CHEMBL258534 | 95763 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 438 | 4 | 5 | 10 | -0.8 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#C[C@H](O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1021/jm0109762 | |||
| 2844 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.6 | 4.6 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.0c01431 | |||
| 60961 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.6 | 4.6 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.0c01431 | |||
| 90 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.6 | 4.6 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL477 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.6 | 4.6 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.0c01431 | |||
| DB00640 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.6 | 4.6 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.0c01431 | |||
| 11026001 | 96325 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 411 | 4 | 5 | 10 | -0.4 | CNc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL261453 | 96325 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 411 | 4 | 5 | 10 | -0.4 | CNc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 69427076 | 77810 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 411 | 4 | 5 | 10 | -0.4 | CNc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL2092786 | 77810 | None | 0 | Human | Binding | pEC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 411 | 4 | 5 | 10 | -0.4 | CNc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 377 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1007/s00044-004-0013-y | |||
| 425 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1007/s00044-004-0013-y | |||
| 448222 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1007/s00044-004-0013-y | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pEC50 | = | 6.5 | 6.5 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1007/s00044-004-0013-y | |||
| 2844 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.3 | 4.3 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| 60961 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.3 | 4.3 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| 90 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.3 | 4.3 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| CHEMBL477 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.3 | 4.3 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| DB00640 | 283 | None | 107 | Human | Binding | pEC50 | = | 4.3 | 4.3 | -467 | 8 | ChEMBL | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.5b01402 | |||
| 70697521 | 77811 | None | 0 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 3 | ChEMBL | 439 | 5 | 5 | 10 | 0.3 | CC(C)Nc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL2092787 | 77811 | None | 0 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 3 | ChEMBL | 439 | 5 | 5 | 10 | 0.3 | CC(C)Nc1nc(C#CC(O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 118719026 | 115433 | None | 0 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 5 | ChEMBL | 582 | 13 | 4 | 8 | 2.1 | CC(C)(C)OC(=O)C1CCCN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1 | 10.1021/jm0109762 | |||
| CHEMBL3350613 | 115433 | None | 0 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 5 | ChEMBL | 582 | 13 | 4 | 8 | 2.1 | CC(C)(C)OC(=O)C1CCCN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1 | 10.1021/jm0109762 | |||
| 9978117 | 158318 | None | 0 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 3 | ChEMBL | 397 | 3 | 5 | 10 | -0.9 | Nc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL408918 | 158318 | None | 0 | Human | Binding | pEC50 | = | 5.2 | 5.2 | - | 3 | ChEMBL | 397 | 3 | 5 | 10 | -0.9 | Nc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 123807 | 870 | None | 54 | Human | Binding | pEC50 | = | 4.1 | 4.1 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/acs.jmedchem.5b01402 | |||
| 374 | 870 | None | 54 | Human | Binding | pEC50 | = | 4.1 | 4.1 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/acs.jmedchem.5b01402 | |||
| 379 | 870 | None | 54 | Human | Binding | pEC50 | = | 4.1 | 4.1 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/acs.jmedchem.5b01402 | |||
| CHEMBL284969 | 870 | None | 54 | Human | Binding | pEC50 | = | 4.1 | 4.1 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/acs.jmedchem.5b01402 | |||
| 10455080 | 95764 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 3 | ChEMBL | 425 | 5 | 5 | 10 | -0.0 | CCNc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL258535 | 95764 | None | 0 | Human | Binding | pEC50 | = | 6.1 | 6.1 | - | 3 | ChEMBL | 425 | 5 | 5 | 10 | -0.0 | CCNc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 11048438 | 168896 | None | 0 | Human | Binding | pEC50 | = | 5.1 | 5.1 | - | 3 | ChEMBL | 439 | 5 | 5 | 10 | 0.3 | CC(C)Nc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL438418 | 168896 | None | 0 | Human | Binding | pEC50 | = | 5.1 | 5.1 | - | 3 | ChEMBL | 439 | 5 | 5 | 10 | 0.3 | CC(C)Nc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 11112711 | 159419 | None | 0 | Human | Binding | pEC50 | = | 5.0 | 5.0 | - | 3 | ChEMBL | 425 | 5 | 5 | 10 | -0.0 | CCNc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL410095 | 159419 | None | 0 | Human | Binding | pEC50 | = | 5.0 | 5.0 | - | 3 | ChEMBL | 425 | 5 | 5 | 10 | -0.0 | CCNc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 44450290 | 96473 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 3 | ChEMBL | 397 | 3 | 5 | 10 | -0.9 | Nc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL262363 | 96473 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 3 | ChEMBL | 397 | 3 | 5 | 10 | -0.9 | Nc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 215492 | 16469 | None | 3 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 3 | ChEMBL | 324 | 4 | 5 | 10 | -2.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCO)[C@@H](O)[C@H]1O | 10.1021/acs.jmedchem.8b01662 | |||
| CHEMBL1234591 | 16469 | None | 3 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 3 | ChEMBL | 324 | 4 | 5 | 10 | -2.9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCO)[C@@H](O)[C@H]1O | 10.1021/acs.jmedchem.8b01662 | |||
| 10455852 | 96051 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 3 | ChEMBL | 439 | 5 | 5 | 10 | 0.3 | CC(C)Nc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| CHEMBL259938 | 96051 | None | 0 | Human | Binding | pEC50 | = | 6.0 | 6.0 | - | 3 | ChEMBL | 439 | 5 | 5 | 10 | 0.3 | CC(C)Nc1nc(C#C[C@@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm0109762 | |||
| 3284 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 5728 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 3284 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 5728 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pIC50 | = | 9.1 | 9.1 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/acs.jmedchem.7b01627 | |||
| 16037920 | 168760 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 571 | 5 | 1 | 7 | 2.5 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Br)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL437309 | 168760 | None | 0 | Human | Binding | pIC50 | = | 9 | 9.0 | - | 0 | ChEMBL | 571 | 5 | 1 | 7 | 2.5 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Br)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 74944536 | 164587 | None | 3 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 540 | 7 | 0 | 7 | 2.8 | CCCN1C(=O)N=C2N=C(c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)cc3)N=C2C1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4215606 | 164587 | None | 3 | Human | Binding | pIC50 | = | 9.0 | 9.0 | - | 0 | ChEMBL | 540 | 7 | 0 | 7 | 2.8 | CCCN1C(=O)N=C2N=C(c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)cc3)N=C2C1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 44413112 | 139303 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 511 | 5 | 1 | 7 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL379217 | 139303 | None | 0 | Human | Binding | pIC50 | = | 8 | 8.0 | - | 0 | ChEMBL | 511 | 5 | 1 | 7 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 134148336 | 148325 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 2 | ChEMBL | 395 | 4 | 2 | 4 | 5.7 | O[C@H]1CC[C@H](Nc2ncc(-c3ccc4ccccc4c3)c(-c3ccccc3)n2)CC1 | 10.1016/j.ejmech.2016.09.081 | |||
| CHEMBL3937015 | 148325 | None | 0 | Human | Binding | pIC50 | = | 6 | 6.0 | - | 2 | ChEMBL | 395 | 4 | 2 | 4 | 5.7 | O[C@H]1CC[C@H](Nc2ncc(-c3ccc4ccccc4c3)c(-c3ccccc3)n2)CC1 | 10.1016/j.ejmech.2016.09.081 | |||
| 2519 | 778 | None | 86 | Human | Binding | pIC50 | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 407 | 778 | None | 86 | Human | Binding | pIC50 | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 463 | 778 | None | 86 | Human | Binding | pIC50 | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pIC50 | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pIC50 | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 44236568 | 156468 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4067401 | 156468 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 155552077 | 175426 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 496 | 6 | 1 | 9 | 2.6 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1nc2cc(S(N)(=O)=O)ccc2o1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4576194 | 175426 | None | 0 | Human | Binding | pIC50 | = | 6.0 | 6.0 | - | 0 | ChEMBL | 496 | 6 | 1 | 9 | 2.6 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1nc2cc(S(N)(=O)=O)ccc2o1 | 10.1016/j.ejmech.2018.11.045 | |||
| 155542641 | 173152 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 424 | 8 | 0 | 8 | 2.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cn3ccnc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4521489 | 173152 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 424 | 8 | 0 | 8 | 2.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cn3ccnc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10237847 | 77457 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 411 | 4 | 2 | 7 | 1.4 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)Nc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL208705 | 77457 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 411 | 4 | 2 | 7 | 1.4 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)Nc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 10196517 | 78321 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 553 | 8 | 2 | 7 | 3.3 | CCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccc(F)cc5)CC4)cc3)cc2n(CC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210969 | 78321 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 553 | 8 | 2 | 7 | 3.3 | CCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccc(F)cc5)CC4)cc3)cc2n(CC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 155568402 | 176009 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 468 | 8 | 1 | 9 | 2.4 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(C)(O)c3cncn3C)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4589654 | 176009 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 468 | 8 | 1 | 9 | 2.4 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(C)(O)c3cncn3C)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 2690 | 902 | None | 66 | Human | Binding | pIC50 | = | 5.9 | 5.9 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm980094b | |||
| 384 | 902 | None | 66 | Human | Binding | pIC50 | = | 5.9 | 5.9 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm980094b | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pIC50 | = | 5.9 | 5.9 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm980094b | |||
| 10812045 | 15519 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 419 | 7 | 1 | 7 | 2.9 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2OC)CC1 | 10.1039/C1MD00213A | |||
| CHEMBL121766 | 15519 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 1 | ChEMBL | 419 | 7 | 1 | 7 | 2.9 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2OC)CC1 | 10.1039/C1MD00213A | |||
| 44413202 | 78391 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 565 | 7 | 1 | 9 | 2.3 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)cc21 | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL211071 | 78391 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 565 | 7 | 1 | 9 | 2.3 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)cc21 | 10.1016/j.bmcl.2006.04.074 | |||
| 155527056 | 171139 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 366 | 5 | 1 | 6 | 2.5 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1ncc[nH]1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4458469 | 171139 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 366 | 5 | 1 | 6 | 2.5 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1ncc[nH]1 | 10.1016/j.ejmech.2018.11.045 | |||
| 155550407 | 173929 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 325 | 4 | 0 | 6 | 2.3 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CC#N | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4540909 | 173929 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 325 | 4 | 0 | 6 | 2.3 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CC#N | 10.1016/j.ejmech.2018.11.045 | |||
| 155525648 | 171091 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 366 | 5 | 1 | 6 | 2.5 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1cnc[nH]1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4457584 | 171091 | None | 0 | Human | Binding | pIC50 | = | 5.9 | 5.9 | - | 0 | ChEMBL | 366 | 5 | 1 | 6 | 2.5 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1cnc[nH]1 | 10.1016/j.ejmech.2018.11.045 | |||
| 10766773 | 208117 | None | 0 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 3 | ChEMBL | 356 | 4 | 2 | 7 | 2.5 | NCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL97961 | 208117 | None | 0 | Human | Binding | pIC50 | = | 4.9 | 4.9 | - | 3 | ChEMBL | 356 | 4 | 2 | 7 | 2.5 | NCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 155515805 | 170005 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 332 | 5 | 0 | 5 | 2.7 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CCF | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4442438 | 170005 | None | 0 | Human | Binding | pIC50 | = | 6.9 | 6.9 | - | 0 | ChEMBL | 332 | 5 | 0 | 5 | 2.7 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CCF | 10.1016/j.ejmech.2018.11.045 | |||
| 155526484 | 171124 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 414 | 8 | 1 | 7 | 2.9 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(O)C3CC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4458223 | 171124 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 414 | 8 | 1 | 7 | 2.9 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(O)C3CC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10288169 | 79757 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 439 | 6 | 2 | 7 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL211762 | 79757 | None | 0 | Human | Binding | pIC50 | = | 7.9 | 7.9 | - | 0 | ChEMBL | 439 | 6 | 2 | 7 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 155515166 | 169929 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 380 | 5 | 0 | 7 | 2.6 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1nccn1C | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4441343 | 169929 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 380 | 5 | 0 | 7 | 2.6 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2Cc1nccn1C | 10.1016/j.ejmech.2018.11.045 | |||
| 44413113 | 78316 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 539 | 7 | 1 | 7 | 2.8 | CCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)cc2n(CC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210931 | 78316 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 539 | 7 | 1 | 7 | 2.8 | CCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)cc2n(CC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 44413192 | 79931 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 483 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCc4ccc(OC)cn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL212528 | 79931 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 483 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCc4ccc(OC)cn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 122574772 | 171085 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 374 | 7 | 1 | 7 | 1.9 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(CO)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4457476 | 171085 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 374 | 7 | 1 | 7 | 1.9 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(CO)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155548802 | 173806 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 428 | 8 | 1 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(C)(O)C3CC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4538262 | 173806 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 428 | 8 | 1 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(C)(O)C3CC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155562247 | 175721 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 370 | 6 | 0 | 6 | 2.9 | COCCn1c(=O)n(CC2(c3ccccc3)CC2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4582620 | 175721 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 370 | 6 | 0 | 6 | 2.9 | COCCn1c(=O)n(CC2(c3ccccc3)CC2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10311222 | 77741 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 493 | 5 | 1 | 7 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL209019 | 77741 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 493 | 5 | 1 | 7 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 155521875 | 170606 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 310 | 4 | 0 | 6 | 2.2 | COCCn1c(=O)n(CC(C)(C)C)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4450782 | 170606 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 310 | 4 | 0 | 6 | 2.2 | COCCn1c(=O)n(CC(C)(C)C)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10310578 | 77787 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 455 | 7 | 2 | 8 | 1.0 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCOc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL209208 | 77787 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 455 | 7 | 2 | 8 | 1.0 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCOc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 10238677 | 79913 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 467 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL212464 | 79913 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 467 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 44413193 | 140130 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 539 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)cc21 | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL380177 | 140130 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 539 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)cc21 | 10.1016/j.bmcl.2006.04.074 | |||
| 155523243 | 170832 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 469 | 7 | 1 | 7 | 2.7 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CCc1ccc(S(N)(=O)=O)cc1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4453664 | 170832 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 469 | 7 | 1 | 7 | 2.7 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CCc1ccc(S(N)(=O)=O)cc1 | 10.1016/j.ejmech.2018.11.045 | |||
| 155533818 | 171894 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 416 | 8 | 0 | 8 | 2.6 | CCOC(=O)c1sc2c(c1C)c(=O)n(CCc1ccccc1)c(=O)n2CCOC | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4469697 | 171894 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 0 | ChEMBL | 416 | 8 | 0 | 8 | 2.6 | CCOC(=O)c1sc2c(c1C)c(=O)n(CCc1ccccc1)c(=O)n2CCOC | 10.1016/j.ejmech.2018.11.045 | |||
| 10577289 | 208071 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 3 | ChEMBL | 384 | 6 | 2 | 7 | 3.3 | NCCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL97700 | 208071 | None | 0 | Human | Binding | pIC50 | = | 5.8 | 5.8 | - | 3 | ChEMBL | 384 | 6 | 2 | 7 | 3.3 | NCCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 10153029 | 78046 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 563 | 10 | 2 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL209944 | 78046 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 563 | 10 | 2 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 10288197 | 78172 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 441 | 5 | 2 | 8 | 1.4 | COc1ccc(NS(=O)(=O)c2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)cn1 | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210456 | 78172 | None | 0 | Human | Binding | pIC50 | = | 7.8 | 7.8 | - | 0 | ChEMBL | 441 | 5 | 2 | 8 | 1.4 | COc1ccc(NS(=O)(=O)c2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)cn1 | 10.1016/j.bmcl.2006.04.074 | |||
| 155521508 | 170702 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 370 | 5 | 0 | 6 | 3.0 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CC1CCCO1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4451942 | 170702 | None | 0 | Human | Binding | pIC50 | = | 6.8 | 6.8 | - | 0 | ChEMBL | 370 | 5 | 0 | 6 | 3.0 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CC1CCCO1 | 10.1016/j.ejmech.2018.11.045 | |||
| 155555355 | 174440 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 452 | 8 | 0 | 9 | 2.4 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)c3cn(C)cn3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4553423 | 174440 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 452 | 8 | 0 | 9 | 2.4 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)c3cn(C)cn3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155551709 | 175141 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 438 | 8 | 1 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cc3nc[nH]c3C)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4569909 | 175141 | None | 0 | Human | Binding | pIC50 | = | 8.6 | 8.6 | - | 0 | ChEMBL | 438 | 8 | 1 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cc3nc[nH]c3C)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 44413182 | 78173 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 455 | 6 | 2 | 8 | 1.1 | COc1ccc(CNS(=O)(=O)c2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)nc1 | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210457 | 78173 | None | 0 | Human | Binding | pIC50 | = | 7.7 | 7.7 | - | 0 | ChEMBL | 455 | 6 | 2 | 8 | 1.1 | COc1ccc(CNS(=O)(=O)c2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)nc1 | 10.1016/j.bmcl.2006.04.074 | |||
| 155521394 | 170588 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 443 | 7 | 1 | 8 | 1.2 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)N3CC(O)C3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4450633 | 170588 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 443 | 7 | 1 | 8 | 1.2 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)N3CC(O)C3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155523200 | 170753 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 427 | 8 | 0 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(CN3CCCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4452532 | 170753 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 427 | 8 | 0 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(CN3CCCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155526352 | 171211 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 358 | 6 | 0 | 6 | 2.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4459477 | 171211 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 358 | 6 | 0 | 6 | 2.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155543633 | 173200 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 405 | 4 | 1 | 7 | 1.3 | CCn1c(=O)c2c(C)c(C(=O)N3CC(O)C3)sc2n(CCC(F)(F)F)c1=O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4522738 | 173200 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 405 | 4 | 1 | 7 | 1.3 | CCn1c(=O)c2c(C)c(C(=O)N3CC(O)C3)sc2n(CCC(F)(F)F)c1=O | 10.1016/j.ejmech.2018.11.045 | |||
| 44236539 | 156790 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4070936 | 156790 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 10645984 | 18815 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 423 | 6 | 1 | 6 | 3.6 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2cccc(Cl)c2)CC1 | 10.1039/C1MD00213A | |||
| CHEMBL127876 | 18815 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 1 | ChEMBL | 423 | 6 | 1 | 6 | 3.6 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2cccc(Cl)c2)CC1 | 10.1039/C1MD00213A | |||
| 155549589 | 173915 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 362 | 6 | 0 | 6 | 2.6 | COCCn1c(=O)n(CCc2ccccc2F)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4540558 | 173915 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 362 | 6 | 0 | 6 | 2.6 | COCCn1c(=O)n(CCc2ccccc2F)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 118016325 | 170071 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 388 | 7 | 1 | 7 | 2.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)O)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4443243 | 170071 | None | 0 | Human | Binding | pIC50 | = | 5.7 | 5.7 | - | 0 | ChEMBL | 388 | 7 | 1 | 7 | 2.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)O)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155514761 | 169889 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 294 | 4 | 0 | 6 | 1.4 | CCn1c(=O)c2c3c(sc2n(CCOC)c1=O)CCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4440686 | 169889 | None | 0 | Human | Binding | pIC50 | = | 6.7 | 6.7 | - | 0 | ChEMBL | 294 | 4 | 0 | 6 | 1.4 | CCn1c(=O)c2c3c(sc2n(CCOC)c1=O)CCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| 45073485 | 163615 | None | 7 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 506 | 7 | 0 | 7 | 2.2 | CCCN1C(=O)N=C2N=C(c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)N=C2C1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4203745 | 163615 | None | 7 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 506 | 7 | 0 | 7 | 2.2 | CCCN1C(=O)N=C2N=C(c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)N=C2C1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 155562338 | 175845 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 448 | 8 | 0 | 7 | 3.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4585480 | 175845 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 448 | 8 | 0 | 7 | 3.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10474279 | 107308 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 369 | 2 | 1 | 6 | 4.2 | CC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL317310 | 107308 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 369 | 2 | 1 | 6 | 4.2 | CC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 10691504 | 207779 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 385 | 2 | 1 | 7 | 4.5 | CC(C)(C)OC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL96041 | 207779 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 385 | 2 | 1 | 7 | 4.5 | CC(C)(C)OC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 10669778 | 117473 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 419 | 7 | 1 | 7 | 2.9 | COc1ccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1 | 10.1039/C1MD00213A | |||
| CHEMBL339936 | 117473 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 419 | 7 | 1 | 7 | 2.9 | COc1ccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1 | 10.1039/C1MD00213A | |||
| 155522968 | 170767 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 442 | 9 | 0 | 7 | 3.9 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(COC3CCCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4452799 | 170767 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 442 | 9 | 0 | 7 | 3.9 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(COC3CCCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155558166 | 174752 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 441 | 7 | 0 | 7 | 2.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)N3CCCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4560841 | 174752 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 441 | 7 | 0 | 7 | 2.7 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)N3CCCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 71600087 | 154355 | None | 54 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 459 | 6 | 2 | 5 | 4.4 | CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2cn(C)c(=O)c3[nH]ccc23)c1 | 10.1021/acs.jmedchem.7b00746 | |||
| CHEMBL3987016 | 154355 | None | 54 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 459 | 6 | 2 | 5 | 4.4 | CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)c(-c2cn(C)c(=O)c3[nH]ccc23)c1 | 10.1021/acs.jmedchem.7b00746 | |||
| 10616222 | 107444 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 327 | 2 | 1 | 6 | 3.1 | CC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL318251 | 107444 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 3 | ChEMBL | 327 | 2 | 1 | 6 | 3.1 | CC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 44413130 | 79956 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 494 | 5 | 1 | 8 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccncc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL212642 | 79956 | None | 0 | Human | Binding | pIC50 | = | 7.6 | 7.6 | - | 0 | ChEMBL | 494 | 5 | 1 | 8 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccncc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 10339165 | 207742 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -2 | 4 | ChEMBL | 370 | 5 | 2 | 7 | 2.9 | NCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL95811 | 207742 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | -2 | 4 | ChEMBL | 370 | 5 | 2 | 7 | 2.9 | NCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 135418256 | 15567 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 326 | 4 | 1 | 5 | 3.7 | CCCCc1nc2[nH]ncc2c2nc(-c3ccc(Cl)cc3)nn12 | 10.1016/j.bmcl.2004.04.099 | |||
| CHEMBL122037 | 15567 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 326 | 4 | 1 | 5 | 3.7 | CCCCc1nc2[nH]ncc2c2nc(-c3ccc(Cl)cc3)nn12 | 10.1016/j.bmcl.2004.04.099 | |||
| 11224 | 581 | None | 35 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 118016229 | 581 | None | 35 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4522981 | 581 | None | 35 | Rat | Binding | pIC50 | = | 6.6 | 6.6 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 155548182 | 173786 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 345 | 6 | 0 | 7 | 1.8 | COCCn1c(=O)n(CCc2cccnc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4537687 | 173786 | None | 0 | Human | Binding | pIC50 | = | 6.6 | 6.6 | - | 0 | ChEMBL | 345 | 6 | 0 | 7 | 1.8 | COCCn1c(=O)n(CCc2cccnc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155536243 | 172178 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 470 | 8 | 0 | 6 | 4.6 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(F)(F)c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4473551 | 172178 | None | 0 | Human | Binding | pIC50 | = | 5.6 | 5.6 | - | 0 | ChEMBL | 470 | 8 | 0 | 6 | 4.6 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(F)(F)c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pIC50 | = | 8.4 | 8.4 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b01627 | |||
| 386 | 1471 | None | 86 | Human | Binding | pIC50 | = | 8.4 | 8.4 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pIC50 | = | 8.4 | 8.4 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b01627 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pIC50 | = | 8.4 | 8.4 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b01627 | |||
| 155519860 | 170413 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 450 | 8 | 1 | 7 | 3.5 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(O)c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4448231 | 170413 | None | 0 | Human | Binding | pIC50 | = | 7.5 | 7.5 | - | 0 | ChEMBL | 450 | 8 | 1 | 7 | 3.5 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(O)c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155544551 | 173392 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 344 | 6 | 0 | 6 | 2.4 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4528081 | 173392 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 0 | ChEMBL | 344 | 6 | 0 | 6 | 2.4 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 449 | 2641 | None | 52 | Human | Binding | pIC50 | = | 7.5 | 7.5 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | nan | |||
| 453 | 2641 | None | 52 | Human | Binding | pIC50 | = | 7.5 | 7.5 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | nan | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pIC50 | = | 7.5 | 7.5 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | nan | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pIC50 | = | 7.5 | 7.5 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | nan | |||
| 71601630 | 86920 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 2 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1021/jm400068e | |||
| CHEMBL2322916 | 86920 | None | 0 | Human | Binding | pIC50 | = | 6.5 | 6.5 | - | 2 | ChEMBL | 225 | 1 | 1 | 5 | 1.7 | Cc1nc(N)c2nn(-c3ccccc3)cc2n1 | 10.1021/jm400068e | |||
| 155517038 | 170157 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 378 | 6 | 0 | 6 | 3.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cl)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4444370 | 170157 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 378 | 6 | 0 | 6 | 3.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cl)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155541364 | 172988 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 380 | 5 | 1 | 6 | 2.9 | Cc1[nH]cnc1Cn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4517977 | 172988 | None | 0 | Human | Binding | pIC50 | = | 5.5 | 5.5 | - | 0 | ChEMBL | 380 | 5 | 1 | 6 | 2.9 | Cc1[nH]cnc1Cn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10717193 | 16780 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 423 | 6 | 1 | 6 | 3.6 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccc(Cl)cc2)CC1 | 10.1039/C1MD00213A | |||
| CHEMBL124485 | 16780 | None | 0 | Human | Binding | pIC50 | = | 5.4 | 5.4 | - | 1 | ChEMBL | 423 | 6 | 1 | 6 | 3.6 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccc(Cl)cc2)CC1 | 10.1039/C1MD00213A | |||
| 155526277 | 171116 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 449 | 7 | 1 | 7 | 2.7 | CCN(CC(C)(C)O)C(=O)c1sc2c(c1C)c(=O)n(CC)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4458042 | 171116 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 449 | 7 | 1 | 7 | 2.7 | CCN(CC(C)(C)O)C(=O)c1sc2c(c1C)c(=O)n(CC)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| 155522797 | 170799 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 308 | 4 | 0 | 6 | 1.8 | CCn1c(=O)c2c3c(sc2n(CCOC)c1=O)CCCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4453228 | 170799 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 308 | 4 | 0 | 6 | 1.8 | CCn1c(=O)c2c3c(sc2n(CCOC)c1=O)CCCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| 155548102 | 173716 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 431 | 8 | 0 | 8 | 2.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)N(C)OC)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4536104 | 173716 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 431 | 8 | 0 | 8 | 2.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)N(C)OC)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 10218183 | 79764 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 533 | 5 | 1 | 8 | 2.5 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL211813 | 79764 | None | 0 | Human | Binding | pIC50 | = | 8.4 | 8.4 | - | 0 | ChEMBL | 533 | 5 | 1 | 8 | 2.5 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 11224 | 581 | None | 35 | Mouse | Binding | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 118016229 | 581 | None | 35 | Mouse | Binding | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4522981 | 581 | None | 35 | Mouse | Binding | pIC50 | = | 6.4 | 6.4 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 1922 | 202816 | None | 44 | Human | Binding | pIC50 | = | 6.4 | 6.4 | -26 | 6 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm990499b | |||
| CHEMBL62350 | 202816 | None | 44 | Human | Binding | pIC50 | = | 6.4 | 6.4 | -26 | 6 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm990499b | |||
| 155520492 | 170480 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 443 | 9 | 0 | 7 | 2.9 | CCN(CC)C(=O)c1sc2c(c1C)c(=O)n(CCc1ccccc1)c(=O)n2CCOC | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4449139 | 170480 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 443 | 9 | 0 | 7 | 2.9 | CCN(CC)C(=O)c1sc2c(c1C)c(=O)n(CCc1ccccc1)c(=O)n2CCOC | 10.1016/j.ejmech.2018.11.045 | |||
| 71601632 | 86922 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 2 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1021/jm400068e | |||
| CHEMBL2322918 | 86922 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 2 | ChEMBL | 301 | 3 | 1 | 5 | 3.0 | Nc1nc(Cc2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1021/jm400068e | |||
| 44413136 | 79265 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 507 | 6 | 2 | 7 | 2.2 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL211347 | 79265 | None | 0 | Human | Binding | pIC50 | = | 7.4 | 7.4 | - | 0 | ChEMBL | 507 | 6 | 2 | 7 | 2.2 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 155518555 | 170292 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 387 | 7 | 1 | 7 | 1.5 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(N)=O)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4446433 | 170292 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 387 | 7 | 1 | 7 | 1.5 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(N)=O)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155537687 | 172329 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 380 | 6 | 0 | 6 | 3.0 | COCCn1c(=O)n(CC(F)(F)c2ccccc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4475483 | 172329 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 380 | 6 | 0 | 6 | 3.0 | COCCn1c(=O)n(CC(F)(F)c2ccccc2)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155560676 | 175113 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 282 | 4 | 0 | 6 | 1.5 | CCn1c(=O)c2c(C)c(C)sc2n(CCOC)c1=O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4569387 | 175113 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 0 | ChEMBL | 282 | 4 | 0 | 6 | 1.5 | CCn1c(=O)c2c(C)c(C)sc2n(CCOC)c1=O | 10.1016/j.ejmech.2018.11.045 | |||
| 71601631 | 86921 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 2 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1021/jm400068e | |||
| CHEMBL2322917 | 86921 | None | 0 | Human | Binding | pIC50 | = | 6.4 | 6.4 | - | 2 | ChEMBL | 287 | 2 | 1 | 5 | 3.1 | Nc1nc(-c2ccccc2)nc2cn(-c3ccccc3)nc12 | 10.1021/jm400068e | |||
| 155512463 | 169633 | None | 0 | Human | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 330 | 6 | 0 | 6 | 2.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2ccsc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4437132 | 169633 | None | 0 | Human | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 330 | 6 | 0 | 6 | 2.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2ccsc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 59351824 | 174024 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 286 | 3 | 1 | 4 | 2.3 | Cc1csc2[nH]c(=O)n(CCc3ccccc3)c(=O)c12 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4543255 | 174024 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 286 | 3 | 1 | 4 | 2.3 | Cc1csc2[nH]c(=O)n(CCc3ccccc3)c(=O)c12 | 10.1016/j.ejmech.2018.11.045 | |||
| 155537810 | 172326 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 384 | 6 | 0 | 6 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c3c(sc21)CCCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4475461 | 172326 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 384 | 6 | 0 | 6 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c3c(sc21)CCCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| 155520204 | 170465 | None | 0 | Human | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 420 | 7 | 0 | 6 | 4.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(-c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4448896 | 170465 | None | 0 | Human | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 420 | 7 | 0 | 6 | 4.1 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(-c3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155559377 | 174846 | None | 0 | Human | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 316 | 5 | 0 | 6 | 2.0 | COCCn1c(=O)n(CC=C(F)F)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4562969 | 174846 | None | 0 | Human | Binding | pIC50 | = | 5.3 | 5.3 | - | 0 | ChEMBL | 316 | 5 | 0 | 6 | 2.0 | COCCn1c(=O)n(CC=C(F)F)c(=O)c2c(C)csc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 11796362 | 115099 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 419 | 7 | 1 | 7 | 2.9 | COc1cccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)c1 | 10.1039/C1MD00213A | |||
| CHEMBL334325 | 115099 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 1 | ChEMBL | 419 | 7 | 1 | 7 | 2.9 | COc1cccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)c1 | 10.1039/C1MD00213A | |||
| 155529645 | 171426 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 421 | 7 | 1 | 7 | 2.0 | CCN(CCO)C(=O)c1sc2c(c1C)c(=O)n(CC)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4462879 | 171426 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 421 | 7 | 1 | 7 | 2.0 | CCN(CCO)C(=O)c1sc2c(c1C)c(=O)n(CC)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| 155521508 | 170702 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 370 | 5 | 0 | 6 | 3.0 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CC1CCCO1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4451942 | 170702 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 370 | 5 | 0 | 6 | 3.0 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CC1CCCO1 | 10.1016/j.ejmech.2018.11.045 | |||
| 155551418 | 173961 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 434 | 8 | 0 | 6 | 4.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cc3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4541543 | 173961 | None | 0 | Human | Binding | pIC50 | = | 6.3 | 6.3 | - | 0 | ChEMBL | 434 | 8 | 0 | 6 | 4.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cc3ccccc3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155569093 | 176001 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 383 | 5 | 0 | 6 | 3.1 | Cc1csc2c1c(=O)n(CCc1cccnc1)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4589448 | 176001 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 383 | 5 | 0 | 6 | 3.1 | Cc1csc2c1c(=O)n(CCc1cccnc1)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| 155537122 | 172263 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 382 | 5 | 0 | 5 | 3.7 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4474572 | 172263 | None | 0 | Human | Binding | pIC50 | = | 7.3 | 7.3 | - | 0 | ChEMBL | 382 | 5 | 0 | 5 | 3.7 | Cc1csc2c1c(=O)n(CCc1ccccc1)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| 10550242 | 17255 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 423 | 6 | 1 | 6 | 3.6 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2Cl)CC1 | 10.1039/C1MD00213A | |||
| CHEMBL125670 | 17255 | None | 0 | Human | Binding | pIC50 | = | 5.2 | 5.2 | - | 1 | ChEMBL | 423 | 6 | 1 | 6 | 3.6 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2Cl)CC1 | 10.1039/C1MD00213A | |||
| 11224 | 581 | None | 35 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 118016229 | 581 | None | 35 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4522981 | 581 | None | 35 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 44413154 | 78003 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 479 | 4 | 1 | 7 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL209742 | 78003 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 479 | 4 | 1 | 7 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 44413106 | 79900 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 546 | 7 | 1 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C#N)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL212416 | 79900 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 546 | 7 | 1 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C#N)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 2690 | 902 | None | 66 | Human | Binding | pIC50 | = | 7.2 | 7.2 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| 384 | 902 | None | 66 | Human | Binding | pIC50 | = | 7.2 | 7.2 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pIC50 | = | 7.2 | 7.2 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| 122574669 | 175830 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 268 | 4 | 0 | 6 | 1.2 | CCn1c(=O)c2c(C)csc2n(CCOC)c1=O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4585015 | 175830 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 0 | ChEMBL | 268 | 4 | 0 | 6 | 1.2 | CCn1c(=O)c2c(C)csc2n(CCOC)c1=O | 10.1016/j.ejmech.2018.11.045 | |||
| 10645103 | 164339 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 407 | 6 | 1 | 6 | 3.0 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2F)CC1 | 10.1039/C1MD00213A | |||
| CHEMBL421256 | 164339 | None | 0 | Human | Binding | pIC50 | = | 6.2 | 6.2 | - | 1 | ChEMBL | 407 | 6 | 1 | 6 | 3.0 | COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2F)CC1 | 10.1039/C1MD00213A | |||
| 11224 | 581 | None | 35 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 118016229 | 581 | None | 35 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4522981 | 581 | None | 35 | Human | Binding | pIC50 | = | 7.2 | 7.2 | - | 1 | ChEMBL | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 10.1016/j.ejmech.2018.11.045 | |||
| 10193 | 3008 | None | 40 | Human | Binding | pIC50 | = | 6.2 | 6.2 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | nan | |||
| 53466958 | 3008 | None | 40 | Human | Binding | pIC50 | = | 6.2 | 6.2 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | nan | |||
| CHEMBL3638684 | 3008 | None | 40 | Human | Binding | pIC50 | = | 6.2 | 6.2 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | nan | |||
| CHEMBL3694769 | 3008 | None | 40 | Human | Binding | pIC50 | = | 6.2 | 6.2 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | nan | |||
| 44413125 | 78075 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 529 | 5 | 1 | 7 | 2.0 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5F)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210088 | 78075 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 529 | 5 | 1 | 7 | 2.0 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5F)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 10196060 | 78147 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 511 | 5 | 1 | 7 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210383 | 78147 | None | 0 | Human | Binding | pIC50 | = | 8.2 | 8.2 | - | 0 | ChEMBL | 511 | 5 | 1 | 7 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 155259564 | 185217 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 339 | 5 | 3 | 9 | 1.2 | Nc1nc(NCCc2ccc(O)cc2)nc2nc(C3=CCCO3)nn12 | nan | |||
| CHEMBL4857871 | 185217 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 339 | 5 | 3 | 9 | 1.2 | Nc1nc(NCCc2ccc(O)cc2)nc2nc(C3=CCCO3)nn12 | nan | |||
| 155559834 | 174918 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 400 | 5 | 0 | 5 | 3.9 | Cc1csc2c1c(=O)n(CCc1ccccc1F)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4564912 | 174918 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 400 | 5 | 0 | 5 | 3.9 | Cc1csc2c1c(=O)n(CCc1ccccc1F)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| 10621961 | 208078 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 3 | ChEMBL | 418 | 4 | 2 | 7 | 4.0 | Nc1ccc(CC(=O)Nc2nc3ccc(Cl)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm980094b | |||
| CHEMBL97748 | 208078 | None | 0 | Human | Binding | pIC50 | = | 5.1 | 5.1 | - | 3 | ChEMBL | 418 | 4 | 2 | 7 | 4.0 | Nc1ccc(CC(=O)Nc2nc3ccc(Cl)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm980094b | |||
| 44413096 | 138968 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 467 | 8 | 2 | 7 | 2.1 | CCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccn4)cc3)cc2n(CC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL378527 | 138968 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 467 | 8 | 2 | 7 | 2.1 | CCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccn4)cc3)cc2n(CC)c1=O | 10.1016/j.bmcl.2006.04.074 | |||
| 155552481 | 174055 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 443 | 8 | 0 | 8 | 2.3 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(CN3CCOCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4544040 | 174055 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 443 | 8 | 0 | 8 | 2.3 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(CN3CCOCC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155541183 | 173010 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 412 | 8 | 0 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)C3CC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4518356 | 173010 | None | 0 | Human | Binding | pIC50 | = | 6.1 | 6.1 | - | 0 | ChEMBL | 412 | 8 | 0 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(C(=O)C3CC3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 155553932 | 175448 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 438 | 8 | 1 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cc3c[nH]c(C)n3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4576817 | 175448 | None | 0 | Human | Binding | pIC50 | = | 8.1 | 8.1 | - | 0 | ChEMBL | 438 | 8 | 1 | 7 | 3.0 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c(C)c(Cc3c[nH]c(C)n3)sc21 | 10.1016/j.ejmech.2018.11.045 | |||
| 57429602 | 157237 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4076435 | 157237 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44413142 | 78209 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 521 | 6 | 1 | 7 | 2.5 | CN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.bmcl.2006.04.074 | |||
| CHEMBL210560 | 78209 | None | 0 | Human | Binding | pIC50 | = | 7.1 | 7.1 | - | 0 | ChEMBL | 521 | 6 | 1 | 7 | 2.5 | CN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.bmcl.2006.04.074 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pIC50 | = | 7.0 | 7.0 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| 405 | 4146 | None | 84 | Human | Binding | pIC50 | = | 7.0 | 7.0 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pIC50 | = | 7.0 | 7.0 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pIC50 | = | 7.0 | 7.0 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b01627 | |||
| 135515408 | 117072 | None | 0 | Human | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 310 | 4 | 1 | 5 | 3.1 | CCCCc1nc2[nH]ncc2c2nc(-c3ccc(F)cc3)nn12 | 10.1016/j.bmcl.2004.04.099 | |||
| CHEMBL339218 | 117072 | None | 0 | Human | Binding | pIC50 | = | 5.0 | 5.0 | - | 0 | ChEMBL | 310 | 4 | 1 | 5 | 3.1 | CCCCc1nc2[nH]ncc2c2nc(-c3ccc(F)cc3)nn12 | 10.1016/j.bmcl.2004.04.099 | |||
| 155540197 | 172900 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 370 | 6 | 0 | 6 | 2.6 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c3c(sc21)CCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4516075 | 172900 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 370 | 6 | 0 | 6 | 2.6 | COCCn1c(=O)n(CCc2ccccc2)c(=O)c2c3c(sc21)CCC3 | 10.1016/j.ejmech.2018.11.045 | |||
| 155549654 | 173904 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 435 | 8 | 0 | 7 | 2.6 | CCN(CC)C(=O)c1sc2c(c1C)c(=O)n(CCOC)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL4540250 | 173904 | None | 0 | Human | Binding | pIC50 | = | 7.0 | 7.0 | - | 0 | ChEMBL | 435 | 8 | 0 | 7 | 2.6 | CCN(CC)C(=O)c1sc2c(c1C)c(=O)n(CCOC)c(=O)n2CCC(F)(F)F | 10.1016/j.ejmech.2018.11.045 | |||
| 450 | 2968 | None | 9 | Human | Binding | pKd | = | 9.8 | 9.8 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| 454 | 2968 | None | 9 | Human | Binding | pKd | = | 9.8 | 9.8 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKd | = | 9.8 | 9.8 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKd | = | 9.8 | 9.8 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| 3284 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 44185871 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 5728 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL483688 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 3284 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 5728 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 3284 | 3214 | None | 35 | Human | Binding | pKd | = | 9.2 | 9.2 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pKd | = | 9.2 | 9.2 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 5728 | 3214 | None | 35 | Human | Binding | pKd | = | 9.2 | 9.2 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pKd | = | 9.2 | 9.2 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 449 | 2641 | None | 52 | Human | Binding | pKd | = | 9.0 | 9.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 453 | 2641 | None | 52 | Human | Binding | pKd | = | 9.0 | 9.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKd | = | 9.0 | 9.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKd | = | 9.0 | 9.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKd | = | 8.8 | 8.8 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2004.03.110 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKd | = | 8.8 | 8.8 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2004.03.110 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKd | = | 8.8 | 8.8 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmcl.2004.03.110 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKd | = | 8.8 | 8.8 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm900413e | |||
| 390 | 2614 | None | 4 | Human | Binding | pKd | = | 8.8 | 8.8 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm900413e | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKd | = | 8.8 | 8.8 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm900413e | |||
| 2690 | 902 | None | 66 | Human | Binding | pKd | = | 8 | 8.0 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm980094b | |||
| 384 | 902 | None | 66 | Human | Binding | pKd | = | 8 | 8.0 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm980094b | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKd | = | 8 | 8.0 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm980094b | |||
| 10339165 | 207742 | None | 0 | Human | Binding | pKd | = | 8 | 8.0 | -2 | 4 | ChEMBL | 370 | 5 | 2 | 7 | 2.9 | NCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| CHEMBL95811 | 207742 | None | 0 | Human | Binding | pKd | = | 8 | 8.0 | -2 | 4 | ChEMBL | 370 | 5 | 2 | 7 | 2.9 | NCCCC(=O)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm980094b | |||
| 7064 | 116712 | None | 98 | Human | Binding | pKd | = | 4.0 | 4.0 | -70 | 4 | ChEMBL | 187 | 1 | 2 | 5 | 0.7 | Nc1nc(N)nc(-c2ccccc2)n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL337319 | 116712 | None | 98 | Human | Binding | pKd | = | 4.0 | 4.0 | -70 | 4 | ChEMBL | 187 | 1 | 2 | 5 | 0.7 | Nc1nc(N)nc(-c2ccccc2)n1 | 10.1021/acsmedchemlett.2c00099 | |||
| 554203 | 191437 | None | 75 | Human | Binding | pKd | = | 4.0 | 4.0 | -1 | 4 | ChEMBL | 177 | 1 | 1 | 4 | 1.8 | Nc1nsc(-c2ccccc2)n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5193006 | 191437 | None | 75 | Human | Binding | pKd | = | 4.0 | 4.0 | -1 | 4 | ChEMBL | 177 | 1 | 1 | 4 | 1.8 | Nc1nsc(-c2ccccc2)n1 | 10.1021/acsmedchemlett.2c00099 | |||
| 2727447 | 150435 | None | 7 | Human | Binding | pKd | = | 3.9 | 3.9 | -109 | 4 | ChEMBL | 211 | 1 | 1 | 5 | 1.4 | Nc1ccc2nnc(-c3ccccc3)n2n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL3954022 | 150435 | None | 7 | Human | Binding | pKd | = | 3.9 | 3.9 | -109 | 4 | ChEMBL | 211 | 1 | 1 | 5 | 1.4 | Nc1ccc2nnc(-c3ccccc3)n2n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL4550896 | 213998 | None | 5 | Human | Binding | pKd | = | 3.9 | 3.9 | -3 | 4 | ChEMBL | None | None | None | O=C(Nc1ccc2ccccc2n1)c1ccco1 | 10.1021/acsmedchemlett.2c00099 | |||||
| 2774349 | 33133 | None | 39 | Human | Binding | pKd | = | 3.9 | 3.9 | -1 | 4 | ChEMBL | 202 | 2 | 1 | 4 | 0.7 | Cc1nn(-c2ccccc2)nc1C(N)=O | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL1417210 | 33133 | None | 39 | Human | Binding | pKd | = | 3.9 | 3.9 | -1 | 4 | ChEMBL | 202 | 2 | 1 | 4 | 0.7 | Cc1nn(-c2ccccc2)nc1C(N)=O | 10.1021/acsmedchemlett.2c00099 | |||
| 344385 | 192207 | None | 49 | Human | Binding | pKd | = | 3.8 | 3.8 | -7 | 4 | ChEMBL | 176 | 0 | 1 | 3 | 0.2 | Cn1c(=O)[nH]c2ccccc2c1=O | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5204663 | 192207 | None | 49 | Human | Binding | pKd | = | 3.8 | 3.8 | -7 | 4 | ChEMBL | 176 | 0 | 1 | 3 | 0.2 | Cn1c(=O)[nH]c2ccccc2c1=O | 10.1021/acsmedchemlett.2c00099 | |||
| 2747546 | 192412 | None | 12 | Human | Binding | pKd | = | 4.7 | 4.7 | -2 | 4 | ChEMBL | 309 | 3 | 1 | 3 | 3.0 | CS(=O)(=O)c1ccc(C(=O)Nc2cccc(Cl)c2)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5208068 | 192412 | None | 12 | Human | Binding | pKd | = | 4.7 | 4.7 | -2 | 4 | ChEMBL | 309 | 3 | 1 | 3 | 3.0 | CS(=O)(=O)c1ccc(C(=O)Nc2cccc(Cl)c2)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| 16362023 | 191442 | None | 4 | Human | Binding | pKd | = | 3.7 | 3.7 | -3 | 4 | ChEMBL | 229 | 3 | 2 | 2 | 2.2 | CC(C)NC(=O)c1cc(-c2ccccc2)[nH]n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5193059 | 191442 | None | 4 | Human | Binding | pKd | = | 3.7 | 3.7 | -3 | 4 | ChEMBL | 229 | 3 | 2 | 2 | 2.2 | CC(C)NC(=O)c1cc(-c2ccccc2)[nH]n1 | 10.1021/acsmedchemlett.2c00099 | |||
| 2314144 | 50481 | None | 4 | Human | Binding | pKd | = | 3.7 | 3.7 | -1 | 4 | ChEMBL | 251 | 3 | 1 | 4 | 2.3 | O=c1cc(NCc2ccccc2)nc2ccccn12 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL1573515 | 50481 | None | 4 | Human | Binding | pKd | = | 3.7 | 3.7 | -1 | 4 | ChEMBL | 251 | 3 | 1 | 4 | 2.3 | O=c1cc(NCc2ccccc2)nc2ccccn12 | 10.1021/acsmedchemlett.2c00099 | |||
| 2823411 | 191578 | None | 5 | Human | Binding | pKd | = | 4.7 | 4.7 | 4 | 4 | ChEMBL | 253 | 3 | 1 | 4 | 2.2 | O=C(NCc1ccccc1)c1ccc2nonc2c1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5195119 | 191578 | None | 5 | Human | Binding | pKd | = | 4.7 | 4.7 | 4 | 4 | ChEMBL | 253 | 3 | 1 | 4 | 2.2 | O=C(NCc1ccccc1)c1ccc2nonc2c1 | 10.1021/acsmedchemlett.2c00099 | |||
| 9857146 | 185186 | None | 1 | Human | Binding | pKd | = | 6.6 | 6.6 | 2 | 4 | ChEMBL | 289 | 2 | 0 | 3 | 4.2 | Fc1ccc(-c2nn3ccccc3c2-c2ccncc2)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL485745 | 185186 | None | 1 | Human | Binding | pKd | = | 6.6 | 6.6 | 2 | 4 | ChEMBL | 289 | 2 | 0 | 3 | 4.2 | Fc1ccc(-c2nn3ccccc3c2-c2ccncc2)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| 135543624 | 16307 | None | 28 | Human | Binding | pKd | = | 5.5 | 5.5 | -16 | 4 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(O)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL122622 | 16307 | None | 28 | Human | Binding | pKd | = | 5.5 | 5.5 | -16 | 4 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(O)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| 221427 | 35331 | None | 35 | Human | Binding | pKd | = | 4.4 | 4.4 | -1 | 4 | ChEMBL | 213 | 2 | 2 | 2 | 2.7 | O=C(Nc1ccccc1)Nc1ccccn1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL143703 | 35331 | None | 35 | Human | Binding | pKd | = | 4.4 | 4.4 | -1 | 4 | ChEMBL | 213 | 2 | 2 | 2 | 2.7 | O=C(Nc1ccccc1)Nc1ccccn1 | 10.1021/acsmedchemlett.2c00099 | |||
| 2794757 | 190886 | None | 46 | Human | Binding | pKd | = | 4.4 | 4.4 | -2 | 4 | ChEMBL | 211 | 1 | 1 | 4 | 2.4 | Nc1nsc(-c2ccc(Cl)cc2)n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5184937 | 190886 | None | 46 | Human | Binding | pKd | = | 4.4 | 4.4 | -2 | 4 | ChEMBL | 211 | 1 | 1 | 4 | 2.4 | Nc1nsc(-c2ccc(Cl)cc2)n1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5080679 | 214699 | None | 0 | Human | Binding | pKd | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | None | None | None | CCCn1c(=O)c2[nH]c(C34CC5CC(CC(C5)C3)C4)nc2n(CCCNC(=O)c2ccc(C(=O)NCCNC(=O)CCNC(=O)CCCCCNC(=O)COc3ccc(/C=C/C4=[N+]5C(=Cc6ccc(-c7cccs7)n6[B-]5(F)F)C=C4)cc3)cc2)c1=O | 10.1021/acs.jmedchem.0c02067 | |||||
| 44583036 | 186953 | None | 0 | Human | Binding | pKd | = | 7.2 | 7.2 | 7 | 5 | ChEMBL | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | 10.1021/jm900413e | |||
| CHEMBL490262 | 186953 | None | 0 | Human | Binding | pKd | = | 7.2 | 7.2 | 7 | 5 | ChEMBL | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | 10.1021/jm900413e | |||
| CHEMBL521280 | 186953 | None | 0 | Human | Binding | pKd | = | 7.2 | 7.2 | 7 | 5 | ChEMBL | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | 10.1021/jm900413e | |||
| 28561 | 181370 | None | 76 | Human | Binding | pKd | = | 4.2 | 4.2 | -1 | 4 | ChEMBL | 177 | 1 | 1 | 4 | 1.8 | Nc1nc(-c2ccccc2)ns1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL47633 | 181370 | None | 76 | Human | Binding | pKd | = | 4.2 | 4.2 | -1 | 4 | ChEMBL | 177 | 1 | 1 | 4 | 1.8 | Nc1nc(-c2ccccc2)ns1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5075285 | 214364 | None | 0 | Human | Binding | pKd | = | 8.1 | 8.1 | -7 | 4 | ChEMBL | None | None | None | CCCn1c(=O)c2[nH]c(C34CCC(C(=O)NCCNC(=O)CCNC(=O)CCNC(=O)CCCCCNC(=O)COc5ccc(/C=C/C6=[N+]7C(=Cc8ccc(-c9cccs9)n8[B-]7(F)F)C=C6)cc5)(CC3)CC4)nc2n(CCC)c1=O | 10.1021/acs.jmedchem.0c02067 | |||||
| 17457984 | 191718 | None | 5 | Human | Binding | pKd | = | 4.1 | 4.1 | -2 | 4 | ChEMBL | 284 | 4 | 1 | 5 | 2.5 | CC(C)n1ncc2cc(C(=O)NCc3ccco3)cnc21 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL5197070 | 191718 | None | 5 | Human | Binding | pKd | = | 4.1 | 4.1 | -2 | 4 | ChEMBL | 284 | 4 | 1 | 5 | 2.5 | CC(C)n1ncc2cc(C(=O)NCc3ccco3)cnc21 | 10.1021/acsmedchemlett.2c00099 | |||
| 136 | 3290 | None | 32 | Rat | Binding | pKd | = | 7.0 | 7.0 | -57 | 16 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| 223 | 3290 | None | 32 | Rat | Binding | pKd | = | 7.0 | 7.0 | -57 | 16 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| 643606 | 3290 | None | 32 | Rat | Binding | pKd | = | 7.0 | 7.0 | -57 | 16 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| CHEMBL10347 | 3290 | None | 32 | Rat | Binding | pKd | = | 7.0 | 7.0 | -57 | 16 | ChEMBL | 354 | 1 | 2 | 4 | 2.6 | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1 | 10.1021/jm00360a008 | |||
| 155555721 | 174391 | None | 7 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 2 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Br)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4552275 | 174391 | None | 7 | Human | Binding | pKi | = | 10.1 | 10.1 | 1 | 2 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Br)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155555721 | 174391 | None | 7 | Mouse | Binding | pKi | = | 9.9 | 9.9 | -1 | 2 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Br)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4552275 | 174391 | None | 7 | Mouse | Binding | pKi | = | 9.9 | 9.9 | -1 | 2 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Br)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155521543 | 170608 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | 645 | 2 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5Br)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4450864 | 170608 | None | 0 | Human | Binding | pKi | = | 9.9 | 9.9 | 645 | 2 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5Br)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155530514 | 171546 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 6 | 5 | ChEMBL | 586 | 7 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Br)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4464522 | 171546 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 6 | 5 | ChEMBL | 586 | 7 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Br)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155550159 | 173901 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 501 | 2 | ChEMBL | 586 | 7 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Br)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4540206 | 173901 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 501 | 2 | ChEMBL | 586 | 7 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Br)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186666 | 185656 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 144 | 5 | ChEMBL | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486478 | 185656 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 144 | 5 | ChEMBL | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155524032 | 170888 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 19054 | 2 | ChEMBL | 620 | 6 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(I)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4454481 | 170888 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 19054 | 2 | ChEMBL | 620 | 6 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(I)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 76328910 | 105519 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | -1 | 4 | ChEMBL | 522 | 8 | 1 | 8 | 2.9 | Cn1c(=O)c2[nH]c(-c3ccc(OCCCN4CCN(Cc5ccccc5Cl)CC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121728 | 105519 | None | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | -1 | 4 | ChEMBL | 522 | 8 | 1 | 8 | 2.9 | Cn1c(=O)c2[nH]c(-c3ccc(OCCCN4CCN(Cc5ccccc5Cl)CC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| 145977111 | 163763 | None | 0 | Rat | Binding | pKi | = | 9.7 | 9.7 | 7 | 4 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4205635 | 163763 | None | 0 | Rat | Binding | pKi | = | 9.7 | 9.7 | 7 | 4 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 44186580 | 184204 | None | 0 | Human | Binding | pKi | = | 9.7 | 9.7 | 30 | 6 | ChEMBL | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL483261 | 184204 | None | 0 | Human | Binding | pKi | = | 9.7 | 9.7 | 30 | 6 | ChEMBL | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155529872 | 171504 | None | 0 | Human | Binding | pKi | = | 9.7 | 9.7 | 165 | 3 | ChEMBL | 558 | 7 | 2 | 8 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)c(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4463929 | 171504 | None | 0 | Human | Binding | pKi | = | 9.7 | 9.7 | 165 | 3 | ChEMBL | 558 | 7 | 2 | 8 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)c(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155532274 | 171695 | None | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | - | 1 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(Br)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4466625 | 171695 | None | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | - | 1 | ChEMBL | 572 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(Br)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155560510 | 175046 | None | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | 851 | 3 | ChEMBL | 549 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(N=[N+]=[N-])cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4567785 | 175046 | None | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | 851 | 3 | ChEMBL | 549 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(N=[N+]=[N-])cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186668 | 191508 | None | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | 245 | 6 | ChEMBL | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL519390 | 191508 | None | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | 245 | 6 | ChEMBL | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186667 | 185657 | None | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | 478 | 6 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486479 | 185657 | None | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | 478 | 6 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155528136 | 171255 | None | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | 158 | 3 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4460114 | 171255 | None | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | 158 | 3 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155545762 | 173477 | None | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | - | 1 | ChEMBL | 558 | 7 | 2 | 8 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)c(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4530074 | 173477 | None | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | - | 1 | ChEMBL | 558 | 7 | 2 | 8 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)c(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186581 | 3203 | None | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 6561 | 3203 | None | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL482436 | 3203 | None | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 155514860 | 169879 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 478 | 3 | ChEMBL | 522 | 7 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4440526 | 169879 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 478 | 3 | ChEMBL | 522 | 7 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 450 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm201292w | |||
| 454 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm201292w | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm201292w | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm201292w | |||
| 155514957 | 169925 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 501 | 2 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5Cl)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4441276 | 169925 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 501 | 2 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5Cl)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44185870 | 184228 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 117 | 5 | ChEMBL | 514 | 5 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL483487 | 184228 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 117 | 5 | ChEMBL | 514 | 5 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 450 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| 454 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/jm900413e | |||
| 155523968 | 170885 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 97 | 3 | ChEMBL | 544 | 6 | 3 | 8 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)c(O)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4454417 | 170885 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 97 | 3 | ChEMBL | 544 | 6 | 3 | 8 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)c(O)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155516277 | 170062 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 331 | 3 | ChEMBL | 508 | 6 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5C)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4443090 | 170062 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 331 | 3 | ChEMBL | 508 | 6 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5C)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186626 | 184607 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 245 | 6 | ChEMBL | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL484900 | 184607 | None | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 245 | 6 | ChEMBL | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44185872 | 191396 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | 416 | 4 | ChEMBL | 524 | 5 | 2 | 7 | 1.9 | C#CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL519253 | 191396 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | 416 | 4 | ChEMBL | 524 | 5 | 2 | 7 | 1.9 | C#CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155561141 | 174972 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | 676 | 3 | ChEMBL | 604 | 7 | 2 | 7 | 2.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Br)c(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4566170 | 174972 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | 676 | 3 | ChEMBL | 604 | 7 | 2 | 7 | 2.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Br)c(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 450 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 454 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 450 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 454 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKi | = | 9.3 | 9.3 | 257 | 4 | ChEMBL | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 127033645 | 139118 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | - | 1 | ChEMBL | 526 | 10 | 3 | 7 | 3.0 | CC(=O)NCCNc1nc(-c2ccccc2)nc2nc(C(=O)N3CCN(CCCc4ccccc4)CC3)[nH]c12 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3786849 | 139118 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | - | 1 | ChEMBL | 526 | 10 | 3 | 7 | 3.0 | CC(=O)NCCNc1nc(-c2ccccc2)nc2nc(C(=O)N3CCN(CCCc4ccccc4)CC3)[nH]c12 | 10.1021/acs.jmedchem.5b01586 | |||
| 127033645 | 139118 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | - | 1 | ChEMBL | 526 | 10 | 3 | 7 | 3.0 | CC(=O)NCCNc1nc(-c2ccccc2)nc2nc(C(=O)N3CCN(CCCc4ccccc4)CC3)[nH]c12 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL3786849 | 139118 | None | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | - | 1 | ChEMBL | 526 | 10 | 3 | 7 | 3.0 | CC(=O)NCCNc1nc(-c2ccccc2)nc2nc(C(=O)N3CCN(CCCc4ccccc4)CC3)[nH]c12 | 10.1021/acs.jmedchem.7b00138 | |||
| 3284 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 5728 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | ChEMBL | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 10.1021/jm900413e | |||
| 44186624 | 192434 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 57 | 4 | ChEMBL | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL520830 | 192434 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 57 | 4 | ChEMBL | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 53324032 | 58027 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 165 | 3 | ChEMBL | 352 | 4 | 1 | 4 | 3.8 | O=C(Nc1cnc(-c2ccncc2F)c(-c2ccccc2F)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672631 | 58027 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 165 | 3 | ChEMBL | 352 | 4 | 1 | 4 | 3.8 | O=C(Nc1cnc(-c2ccncc2F)c(-c2ccccc2F)n1)C1CC1 | 10.1021/ml100249e | |||
| 44186582 | 184111 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 158 | 4 | ChEMBL | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL482638 | 184111 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 158 | 4 | ChEMBL | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155525050 | 170977 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 316 | 2 | ChEMBL | 524 | 7 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4456096 | 170977 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 316 | 2 | ChEMBL | 524 | 7 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155530257 | 171520 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 213 | 2 | ChEMBL | 556 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)c(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4464175 | 171520 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 213 | 2 | ChEMBL | 556 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)c(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155531990 | 171706 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 1 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4466765 | 171706 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 1 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155564465 | 175255 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 190 | 3 | ChEMBL | 494 | 6 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4572369 | 175255 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 190 | 3 | ChEMBL | 494 | 6 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155534836 | 171995 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 165 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4471205 | 171995 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 165 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 168297247 | 192375 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(N=C=S)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5207498 | 192375 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(N=C=S)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 168296088 | 192364 | None | 1 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5207290 | 192364 | None | 1 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 44186625 | 184606 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 208 | 6 | ChEMBL | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL484899 | 184606 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 208 | 6 | ChEMBL | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155530381 | 171562 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | 508 | 6 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4464738 | 171562 | None | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | - | 1 | ChEMBL | 508 | 6 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186669 | 185795 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 354 | 6 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486688 | 185795 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 354 | 6 | ChEMBL | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186622 | 184227 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 208 | 6 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL483469 | 184227 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 208 | 6 | ChEMBL | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44574165 | 189465 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 2 | 6 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL513681 | 189465 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 2 | 6 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 44186715 | 191217 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 54 | 4 | ChEMBL | 522 | 7 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL518972 | 191217 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 54 | 4 | ChEMBL | 522 | 7 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186718 | 184171 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 117 | 6 | ChEMBL | 538 | 6 | 2 | 9 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL483065 | 184171 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 117 | 6 | ChEMBL | 538 | 6 | 2 | 9 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155522541 | 170809 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 275 | 2 | ChEMBL | 556 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)c(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4453324 | 170809 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 275 | 2 | ChEMBL | 556 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)c(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44236421 | 156569 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | - | 1 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4068507 | 156569 | None | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | - | 1 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 155530514 | 171546 | None | 0 | Mouse | Binding | pKi | = | 9.0 | 9.0 | -6 | 5 | ChEMBL | 586 | 7 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Br)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4464522 | 171546 | None | 0 | Mouse | Binding | pKi | = | 9.0 | 9.0 | -6 | 5 | ChEMBL | 586 | 7 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Br)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155531990 | 171706 | None | 0 | Mouse | Binding | pKi | = | 9.0 | 9.0 | -1 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4466765 | 171706 | None | 0 | Mouse | Binding | pKi | = | 9.0 | 9.0 | -1 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186717 | 184143 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 89 | 6 | ChEMBL | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL482855 | 184143 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 89 | 6 | ChEMBL | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 76336198 | 105517 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | -13 | 2 | ChEMBL | 340 | 3 | 1 | 6 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(OC4CCCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121726 | 105517 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | -13 | 2 | ChEMBL | 340 | 3 | 1 | 6 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(OC4CCCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| 135543624 | 16307 | None | 28 | Human | Binding | pKi | = | 9 | 9.0 | -16 | 4 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(O)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| CHEMBL122622 | 16307 | None | 28 | Human | Binding | pKi | = | 9 | 9.0 | -16 | 4 | ChEMBL | 348 | 4 | 3 | 7 | 2.8 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccc(O)cc1 | 10.1021/acsmedchemlett.2c00099 | |||
| 66894241 | 157811 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 114 | 3 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4083317 | 157811 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 114 | 3 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 66899873 | 158932 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | 569 | 9 | 1 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4095766 | 158932 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | 569 | 9 | 1 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44451166 | 95963 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | 620 | 7 | 1 | 9 | 4.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259479 | 95963 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | - | 1 | ChEMBL | 620 | 7 | 1 | 9 | 4.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 46866593 | 5938 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 151 | 3 | ChEMBL | 323 | 4 | 1 | 4 | 3.9 | O=C(Nc1ccc(-c2ccncc2F)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1079804 | 5938 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 151 | 3 | ChEMBL | 323 | 4 | 1 | 4 | 3.9 | O=C(Nc1ccc(-c2ccncc2F)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46880424 | 6049 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 181 | 4 | ChEMBL | 307 | 2 | 2 | 6 | 1.3 | O=c1[nH]c(=O)c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1080513 | 6049 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 181 | 4 | ChEMBL | 307 | 2 | 2 | 6 | 1.3 | O=c1[nH]c(=O)c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1 | 10.1016/j.bmcl.2010.01.077 | |||
| 46866591 | 6304 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 30 | 4 | ChEMBL | 305 | 4 | 1 | 4 | 3.8 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081812 | 6304 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 30 | 4 | ChEMBL | 305 | 4 | 1 | 4 | 3.8 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 16071901 | 58019 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 25 | 4 | ChEMBL | 334 | 4 | 1 | 4 | 3.7 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccccc2F)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672623 | 58019 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 25 | 4 | ChEMBL | 334 | 4 | 1 | 4 | 3.7 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccccc2F)n1)C1CC1 | 10.1021/ml100249e | |||
| 44587956 | 174770 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | -2 | 6 | ChEMBL | 554 | 9 | 3 | 7 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL456125 | 174770 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | -2 | 6 | ChEMBL | 554 | 9 | 3 | 7 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11705261 | 72989 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 371 | 4 | ChEMBL | 460 | 8 | 1 | 10 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200779 | 72989 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 371 | 4 | ChEMBL | 460 | 8 | 1 | 10 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 9822488 | 77623 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 691 | 4 | ChEMBL | 404 | 3 | 1 | 7 | 1.9 | Cn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL208824 | 77623 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 691 | 4 | ChEMBL | 404 | 3 | 1 | 7 | 1.9 | Cn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(C)c1=O | 10.1021/jm7014815 | |||
| 9822488 | 77623 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 691 | 4 | ChEMBL | 404 | 3 | 1 | 7 | 1.9 | Cn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL208824 | 77623 | None | 0 | Human | Binding | pKi | = | 9 | 9.0 | 691 | 4 | ChEMBL | 404 | 3 | 1 | 7 | 1.9 | Cn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(C)c1=O | 10.1021/jm051268+ | |||
| 155532514 | 171765 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 154 | 2 | ChEMBL | 556 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cc(F)cc(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4467573 | 171765 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 154 | 2 | ChEMBL | 556 | 8 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cc(F)cc(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44451166 | 95963 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | - | 1 | ChEMBL | 620 | 7 | 1 | 9 | 4.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259479 | 95963 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | - | 1 | ChEMBL | 620 | 7 | 1 | 9 | 4.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 76325371 | 105518 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | -25 | 4 | ChEMBL | 380 | 6 | 1 | 8 | 1.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCCCn4ccnc4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121727 | 105518 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | -25 | 4 | ChEMBL | 380 | 6 | 1 | 8 | 1.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCCCn4ccnc4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| 44186719 | 185914 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 74 | 6 | ChEMBL | 552 | 7 | 2 | 9 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486893 | 185914 | None | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 74 | 6 | ChEMBL | 552 | 7 | 2 | 9 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186579 | 191782 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 131 | 6 | ChEMBL | 494 | 6 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL519813 | 191782 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 131 | 6 | ChEMBL | 494 | 6 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44186716 | 184112 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 194 | 6 | ChEMBL | 524 | 7 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL482648 | 184112 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 194 | 6 | ChEMBL | 524 | 7 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44583036 | 186953 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 7 | 5 | ChEMBL | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | 10.1021/jm900413e | |||
| CHEMBL490262 | 186953 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 7 | 5 | ChEMBL | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | 10.1021/jm900413e | |||
| CHEMBL521280 | 186953 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 7 | 5 | ChEMBL | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | 10.1021/jm900413e | |||
| 57429647 | 158635 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 573 | 9 | 2 | 9 | 3.0 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(O)C4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4092455 | 158635 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 573 | 9 | 2 | 9 | 3.0 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(O)C4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 10875138 | 138388 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 19 | 4 | ChEMBL | 532 | 9 | 2 | 8 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5OC)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37726 | 138388 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 19 | 4 | ChEMBL | 532 | 9 | 2 | 8 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5OC)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 10452788 | 162289 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 28 | 5 | ChEMBL | 387 | 8 | 4 | 7 | -0.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL416417 | 162289 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 28 | 5 | ChEMBL | 387 | 8 | 4 | 7 | -0.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 155556884 | 174577 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 542 | 7 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)c(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4556744 | 174577 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 542 | 7 | 2 | 8 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)c(F)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44186623 | 192087 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 31 | 6 | ChEMBL | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL520297 | 192087 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 31 | 6 | ChEMBL | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 155512438 | 169643 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 102 | 3 | ChEMBL | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4437222 | 169643 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 102 | 3 | ChEMBL | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(OC)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 57429619 | 158134 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 442 | 4 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4ccc(C(F)(F)F)cc4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4087158 | 158134 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 442 | 4 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4ccc(C(F)(F)F)cc4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 10075248 | 141244 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 28 | 5 | ChEMBL | 516 | 9 | 2 | 7 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL38304 | 141244 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 28 | 5 | ChEMBL | 516 | 9 | 2 | 7 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 145977111 | 163763 | None | 0 | Mouse | Binding | pKi | = | 8.9 | 8.9 | -7 | 4 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4205635 | 163763 | None | 0 | Mouse | Binding | pKi | = | 8.9 | 8.9 | -7 | 4 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 11605883 | 79950 | None | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | 42 | 6 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL212625 | 79950 | None | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | 42 | 6 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 76325369 | 105514 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | -4 | 4 | ChEMBL | 385 | 5 | 1 | 8 | 0.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCCN4CCOCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121723 | 105514 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | -4 | 4 | ChEMBL | 385 | 5 | 1 | 8 | 0.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCCN4CCOCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| 3287 | 2640 | None | 43 | Human | Binding | pKi | = | 8.9 | 8.9 | 27 | 6 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1021/acs.jmedchem.1c00261 | |||
| 5139184 | 2640 | None | 43 | Human | Binding | pKi | = | 8.9 | 8.9 | 27 | 6 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL17002 | 2640 | None | 43 | Human | Binding | pKi | = | 8.9 | 8.9 | 27 | 6 | ChEMBL | 503 | 10 | 2 | 8 | 3.6 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C | 10.1021/acs.jmedchem.1c00261 | |||
| 46229140 | 199643 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 517 | 10 | 1 | 9 | 3.6 | CCCn1c(=O)c2c(nc(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)n2C)n(CCC)c1=O | 10.1016/j.bmc.2010.02.014 | |||
| CHEMBL592891 | 199643 | None | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | - | 1 | ChEMBL | 517 | 10 | 1 | 9 | 3.6 | CCCn1c(=O)c2c(nc(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)n2C)n(CCC)c1=O | 10.1016/j.bmc.2010.02.014 | |||
| 44236600 | 158245 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | - | 1 | ChEMBL | 484 | 6 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(F)(F)F)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4088514 | 158245 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | - | 1 | ChEMBL | 484 | 6 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(F)(F)F)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 57429649 | 158940 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 23 | 3 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4095843 | 158940 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 23 | 3 | ChEMBL | 572 | 8 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44451075 | 96074 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 75 | 2 | ChEMBL | 563 | 9 | 1 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260051 | 96074 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 75 | 2 | ChEMBL | 563 | 9 | 1 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 9825550 | 57590 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 6 | ChEMBL | 461 | 9 | 2 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL16677 | 57590 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 2 | 6 | ChEMBL | 461 | 9 | 2 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451075 | 96074 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 75 | 2 | ChEMBL | 563 | 9 | 1 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260051 | 96074 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 75 | 2 | ChEMBL | 563 | 9 | 1 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11684701 | 133433 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 17 | 2 | ChEMBL | 496 | 5 | 2 | 6 | 3.4 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccc(Br)cc1 | 10.1021/jm0506221 | |||
| CHEMBL370588 | 133433 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 17 | 2 | ChEMBL | 496 | 5 | 2 | 6 | 3.4 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccc(Br)cc1 | 10.1021/jm0506221 | |||
| 44186670 | 192300 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 24 | 4 | ChEMBL | 508 | 6 | 2 | 7 | 1.9 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL520617 | 192300 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 24 | 4 | ChEMBL | 508 | 6 | 2 | 7 | 1.9 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 57429620 | 155807 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | - | 1 | ChEMBL | 458 | 5 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4ccc(OC(F)(F)F)cc4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4059779 | 155807 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | - | 1 | ChEMBL | 458 | 5 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4ccc(OC(F)(F)F)cc4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 57429617 | 157464 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | - | 1 | ChEMBL | 392 | 4 | 2 | 6 | 1.9 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4ccc(F)cc4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4079273 | 157464 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | - | 1 | ChEMBL | 392 | 4 | 2 | 6 | 1.9 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4ccc(F)cc4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 155536745 | 172201 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 208 | 3 | ChEMBL | 467 | 8 | 2 | 6 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N(C)CCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4473749 | 172201 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 208 | 3 | ChEMBL | 467 | 8 | 2 | 6 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N(C)CCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44574251 | 178427 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 12 | 2 | ChEMBL | 451 | 8 | 2 | 8 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccon4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL466035 | 178427 | None | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 12 | 2 | ChEMBL | 451 | 8 | 2 | 8 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccon4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 44236445 | 157538 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 556 | 8 | 1 | 9 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(F)c(Cl)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4080171 | 157538 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 556 | 8 | 1 | 9 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(F)c(Cl)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44451329 | 96181 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 204 | 2 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cc1ccc(N2CCN(C(=O)C(C)Oc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260692 | 96181 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 204 | 2 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cc1ccc(N2CCN(C(=O)C(C)Oc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| 145977111 | 163763 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -10 | 4 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4205635 | 163763 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -10 | 4 | ChEMBL | 617 | 9 | 3 | 7 | 3.9 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.7b00138 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.7b00138 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.7b00138 | |||
| 44276476 | 168092 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 13 | 3 | ChEMBL | 475 | 9 | 2 | 7 | 3.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL432664 | 168092 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 13 | 3 | ChEMBL | 475 | 9 | 2 | 7 | 3.7 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 155528717 | 171346 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 546 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5F)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4461478 | 171346 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 546 | 6 | 2 | 7 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5F)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155548264 | 173766 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 4 | 3 | ChEMBL | 542 | 6 | 1 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)nc2n(C)c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4537196 | 173766 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 4 | 3 | ChEMBL | 542 | 6 | 1 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)nc2n(C)c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.0c01431 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.0c01431 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.0c01431 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 76310832 | 105515 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -9 | 4 | ChEMBL | 369 | 5 | 1 | 7 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCCN4CCCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121724 | 105515 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -9 | 4 | ChEMBL | 369 | 5 | 1 | 7 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCCN4CCCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm011049y | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm011049y | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm011049y | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm011049y | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.5b01586 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.5b01586 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.5b01586 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.1c00261 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.1c00261 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.1c00261 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 44185874 | 185658 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 20 | 5 | ChEMBL | 524 | 7 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486481 | 185658 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 20 | 5 | ChEMBL | 524 | 7 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0506221 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0506221 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0506221 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0506221 | |||
| 135522368 | 492 | None | 1 | Human | Binding | pKi | = | 8 | 8.0 | 117 | 2 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| 383 | 492 | None | 1 | Human | Binding | pKi | = | 8 | 8.0 | 117 | 2 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| CHEMBL33491 | 492 | None | 1 | Human | Binding | pKi | = | 8 | 8.0 | 117 | 2 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| 135522368 | 492 | None | 1 | Human | Binding | pKi | = | 8 | 8.0 | 117 | 2 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| 383 | 492 | None | 1 | Human | Binding | pKi | = | 8 | 8.0 | 117 | 2 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| CHEMBL33491 | 492 | None | 1 | Human | Binding | pKi | = | 8 | 8.0 | 117 | 2 | ChEMBL | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 10.1021/jm0309654 | |||
| 16072023 | 58010 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 1 | 4 | ChEMBL | 308 | 4 | 1 | 5 | 3.4 | CC(C)C(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| CHEMBL1672614 | 58010 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 1 | 4 | ChEMBL | 308 | 4 | 1 | 5 | 3.4 | CC(C)C(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| 44574166 | 178703 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 1 | 2 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cccs4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL468295 | 178703 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 1 | 2 | ChEMBL | 410 | 4 | 2 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cccs4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 136042341 | 71165 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 17 | 2 | ChEMBL | 517 | 8 | 2 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955917 | 71165 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 17 | 2 | ChEMBL | 517 | 8 | 2 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 49797794 | 10586 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 5 | 3 | ChEMBL | 394 | 5 | 1 | 6 | 3.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C#N)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1169934 | 10586 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 5 | 3 | ChEMBL | 394 | 5 | 1 | 6 | 3.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C#N)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 9901196 | 188831 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | -2 | 4 | ChEMBL | 308 | 3 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(O)c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL506511 | 188831 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | -2 | 4 | ChEMBL | 308 | 3 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(O)c3)c2n1 | 10.1021/jm800961g | |||
| 11760836 | 100217 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 2 | 3 | ChEMBL | 386 | 8 | 4 | 7 | -0.1 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)NCCN)cc3)nc2c1=O | 10.1021/jm049513x | |||
| CHEMBL288459 | 100217 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 2 | 3 | ChEMBL | 386 | 8 | 4 | 7 | -0.1 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)NCCN)cc3)nc2c1=O | 10.1021/jm049513x | |||
| 11760836 | 100217 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 2 | 3 | ChEMBL | 386 | 8 | 4 | 7 | -0.1 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)NCCN)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL288459 | 100217 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | 2 | 3 | ChEMBL | 386 | 8 | 4 | 7 | -0.1 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)NCCN)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 2748282 | 103852 | None | 7 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091713 | 103852 | None | 7 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 2748282 | 103852 | None | 7 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=S)N1 | 10.1021/ml400185v | |||
| CHEMBL3091713 | 103852 | None | 7 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=S)N1 | 10.1021/ml400185v | |||
| 136042354 | 71152 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 72 | 2 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955903 | 71152 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 72 | 2 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 9904456 | 99146 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | -8 | 4 | ChEMBL | 301 | 2 | 1 | 9 | 1.6 | CSc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL281129 | 99146 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | -8 | 4 | ChEMBL | 301 | 2 | 1 | 9 | 1.6 | CSc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.0 | 8.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2012.05.033 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.0 | 8.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2012.05.033 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.0 | 8.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2012.05.033 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.0 | 8.0 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2012.05.033 | |||
| 44451229 | 155195 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 77 | 2 | ChEMBL | 620 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL402474 | 155195 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 77 | 2 | ChEMBL | 620 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 69030712 | 157959 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 489 | 8 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(C)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4084760 | 157959 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 489 | 8 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(C)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44236419 | 159154 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 540 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(F)cc5F)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4098199 | 159154 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 540 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(F)cc5F)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11584027 | 139556 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 10 | 2 | ChEMBL | 491 | 10 | 2 | 8 | 3.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)nc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL379688 | 139556 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 10 | 2 | ChEMBL | 491 | 10 | 2 | 8 | 3.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)nc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 10981207 | 133523 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 7 | 4 | ChEMBL | 358 | 7 | 3 | 6 | 1.3 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37082 | 133523 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 7 | 4 | ChEMBL | 358 | 7 | 3 | 6 | 1.3 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 11656570 | 73408 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 8 | 2 | ChEMBL | 522 | 11 | 2 | 10 | 2.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4cc(OC)nc(OC)n4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201594 | 73408 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 8 | 2 | ChEMBL | 522 | 11 | 2 | 10 | 2.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4cc(OC)nc(OC)n4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11632785 | 73534 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 13 | 4 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201721 | 73534 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 13 | 4 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451254 | 156887 | None | 10 | Human | Binding | pKi | = | 8.0 | 8.0 | 912 | 2 | ChEMBL | 592 | 5 | 1 | 9 | 4.0 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL407204 | 156887 | None | 10 | Human | Binding | pKi | = | 8.0 | 8.0 | 912 | 2 | ChEMBL | 592 | 5 | 1 | 9 | 4.0 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 135529371 | 109183 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 8 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OC)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32150 | 109183 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 8 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OC)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11505071 | 72582 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -1 | 2 | ChEMBL | 566 | 10 | 3 | 11 | 1.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)c4c(NC(=O)O)n(C)c(=O)n(C)c4=O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199280 | 72582 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -1 | 2 | ChEMBL | 566 | 10 | 3 | 11 | 1.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)c4c(NC(=O)O)n(C)c(=O)n(C)c4=O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 9844693 | 82205 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -10 | 3 | ChEMBL | 414 | 7 | 2 | 6 | 2.9 | CCCn1c(=O)c2nc([C@]34CC[C@](/C=C/C(=O)O)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL217076 | 82205 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -10 | 3 | ChEMBL | 414 | 7 | 2 | 6 | 2.9 | CCCn1c(=O)c2nc([C@]34CC[C@](/C=C/C(=O)O)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 137649458 | 157145 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | - | 1 | ChEMBL | 438 | 6 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CC4(O)CCCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4075201 | 157145 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | - | 1 | ChEMBL | 438 | 6 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CC4(O)CCCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44451165 | 158799 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | - | 1 | ChEMBL | 531 | 9 | 1 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cnccn5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL409440 | 158799 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | - | 1 | ChEMBL | 531 | 9 | 1 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cnccn5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 46837563 | 10588 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | - | 1 | ChEMBL | 436 | 7 | 3 | 5 | 3.3 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1169969 | 10588 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | - | 1 | ChEMBL | 436 | 7 | 3 | 5 | 3.3 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| 44406567 | 72692 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 6 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccccc5C(F)(F)F)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL199692 | 72692 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 6 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccccc5C(F)(F)F)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11618633 | 78122 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -1 | 3 | ChEMBL | 420 | 9 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc(-c3cnn(CCCc4ccccc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210319 | 78122 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -1 | 3 | ChEMBL | 420 | 9 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc(-c3cnn(CCCc4ccccc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 10193 | 3008 | None | 40 | Human | Binding | pKi | = | 6 | 6.0 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | 10.1021/acs.jmedchem.0c00237 | |||
| 53466958 | 3008 | None | 40 | Human | Binding | pKi | = | 6 | 6.0 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL3638684 | 3008 | None | 40 | Human | Binding | pKi | = | 6 | 6.0 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL3694769 | 3008 | None | 40 | Human | Binding | pKi | = | 6 | 6.0 | -46 | 4 | ChEMBL | 305 | 2 | 1 | 7 | 1.2 | Nc1nc(nc(c1Br)n1cccn1)n1cccn1 | 10.1021/acs.jmedchem.0c00237 | |||
| 155521637 | 170665 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | -25 | 3 | ChEMBL | 313 | 2 | 1 | 4 | 3.7 | Clc1cccc(-c2nc(N3CCCCC3)c3nc[nH]c3n2)c1 | 10.1016/j.bmc.2019.06.034 | |||
| CHEMBL4451553 | 170665 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | -25 | 3 | ChEMBL | 313 | 2 | 1 | 4 | 3.7 | Clc1cccc(-c2nc(N3CCCCC3)c3nc[nH]c3n2)c1 | 10.1016/j.bmc.2019.06.034 | |||
| 70686119 | 75445 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | -1 | 2 | ChEMBL | 338 | 5 | 3 | 5 | 2.4 | COc1cccc2cc(C(=O)NCC(O)c3ccccc3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042072 | 75445 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | -1 | 2 | ChEMBL | 338 | 5 | 3 | 5 | 2.4 | COc1cccc2cc(C(=O)NCC(O)c3ccccc3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 6032251 | 75453 | None | 3 | Human | Binding | pKi | = | 6 | 6.0 | -3 | 3 | ChEMBL | 233 | 3 | 1 | 5 | 1.5 | COC(=O)/C(C#N)=C/c1cccc(OC)c1O | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042091 | 75453 | None | 3 | Human | Binding | pKi | = | 6 | 6.0 | -3 | 3 | ChEMBL | 233 | 3 | 1 | 5 | 1.5 | COC(=O)/C(C#N)=C/c1cccc(OC)c1O | 10.1016/j.ejmech.2012.05.009 | |||
| 2989630 | 104032 | None | 13 | Human | Binding | pKi | = | 5 | 5.0 | -67 | 5 | ChEMBL | 329 | 1 | 0 | 7 | 1.1 | Cn1c(=O)c2c(nc3n2CCCN3c2ccc(F)cc2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093328 | 104032 | None | 13 | Human | Binding | pKi | = | 5 | 5.0 | -67 | 5 | ChEMBL | 329 | 1 | 0 | 7 | 1.1 | Cn1c(=O)c2c(nc3n2CCCN3c2ccc(F)cc2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 137632333 | 156529 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1348 | 4 | ChEMBL | 445 | 6 | 1 | 7 | 4.1 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4068032 | 156529 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1348 | 4 | ChEMBL | 445 | 6 | 1 | 7 | 4.1 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 70688247 | 75441 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -25 | 2 | ChEMBL | 476 | 8 | 4 | 8 | 2.7 | COc1cccc2cc(C(=O)NCCCNC(=O)c3cc4cccc(OC)c4oc3=N)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042060 | 75441 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -25 | 2 | ChEMBL | 476 | 8 | 4 | 8 | 2.7 | COc1cccc2cc(C(=O)NCCCNC(=O)c3cc4cccc(OC)c4oc3=N)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 70683991 | 75442 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -31 | 3 | ChEMBL | 602 | 12 | 4 | 10 | 2.7 | COc1cccc2cc(C(=O)NCCCN3CCN(CCCNC(=O)c4cc5cccc(OC)c5oc4=N)CC3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042061 | 75442 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -31 | 3 | ChEMBL | 602 | 12 | 4 | 10 | 2.7 | COc1cccc2cc(C(=O)NCCCN3CCN(CCCNC(=O)c4cc5cccc(OC)c5oc4=N)CC3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 2989630 | 104032 | None | 13 | Human | Binding | pKi | = | 5 | 5.0 | -67 | 5 | ChEMBL | 329 | 1 | 0 | 7 | 1.1 | Cn1c(=O)c2c(nc3n2CCCN3c2ccc(F)cc2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093328 | 104032 | None | 13 | Human | Binding | pKi | = | 5 | 5.0 | -67 | 5 | ChEMBL | 329 | 1 | 0 | 7 | 1.1 | Cn1c(=O)c2c(nc3n2CCCN3c2ccc(F)cc2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 11081 | 3215 | None | 5 | Human | Binding | pKi | = | 5 | 5.0 | -30 | 6 | ChEMBL | 378 | 3 | 1 | 7 | 1.4 | Cn1c(=O)n(C)c(=O)c2c1nc1n2CCCN1CCc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2007.07.051 | |||
| 44437220 | 3215 | None | 5 | Human | Binding | pKi | = | 5 | 5.0 | -30 | 6 | ChEMBL | 378 | 3 | 1 | 7 | 1.4 | Cn1c(=O)n(C)c(=O)c2c1nc1n2CCCN1CCc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2007.07.051 | |||
| CHEMBL239232 | 3215 | None | 5 | Human | Binding | pKi | = | 5 | 5.0 | -30 | 6 | ChEMBL | 378 | 3 | 1 | 7 | 1.4 | Cn1c(=O)n(C)c(=O)c2c1nc1n2CCCN1CCc1c[nH]c2c1cccc2 | 10.1016/j.bmc.2007.07.051 | |||
| 3162488 | 91142 | None | 10 | Human | Binding | pKi | = | 5 | 5.0 | -31 | 5 | ChEMBL | 339 | 3 | 0 | 7 | 0.9 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| CHEMBL239864 | 91142 | None | 10 | Human | Binding | pKi | = | 5 | 5.0 | -31 | 5 | ChEMBL | 339 | 3 | 0 | 7 | 0.9 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| 11003653 | 145836 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -2 | 4 | ChEMBL | 389 | 4 | 0 | 8 | 1.4 | Cn1c(=O)c2c(nc3n2CCCN3CCOc2ccc(Cl)cc2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| CHEMBL391718 | 145836 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -2 | 4 | ChEMBL | 389 | 4 | 0 | 8 | 1.4 | Cn1c(=O)c2c(nc3n2CCCN3CCOc2ccc(Cl)cc2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2018.11.045 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2018.11.045 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2018.11.045 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2018.11.045 | |||
| 3280 | 4060 | None | 43 | Human | Binding | pKi | = | 5 | 5.0 | -245 | 4 | ChEMBL | 371 | 4 | 2 | 5 | 4.3 | COc1ccccc1NC(=O)Nc1nc(nc2c1cccc2)c1cccnc1 | 10.1021/jm0003945 | |||
| 4046493 | 4060 | None | 43 | Human | Binding | pKi | = | 5 | 5.0 | -245 | 4 | ChEMBL | 371 | 4 | 2 | 5 | 4.3 | COc1ccccc1NC(=O)Nc1nc(nc2c1cccc2)c1cccnc1 | 10.1021/jm0003945 | |||
| CHEMBL70880 | 4060 | None | 43 | Human | Binding | pKi | = | 5 | 5.0 | -245 | 4 | ChEMBL | 371 | 4 | 2 | 5 | 4.3 | COc1ccccc1NC(=O)Nc1nc(nc2c1cccc2)c1cccnc1 | 10.1021/jm0003945 | |||
| 162677251 | 183535 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 278 | 4 | 2 | 3 | 3.0 | CC1=C(C(=O)CC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4800076 | 183535 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 278 | 4 | 2 | 3 | 3.0 | CC1=C(C(=O)CC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 162643106 | 181653 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 262 | 4 | 2 | 3 | 2.5 | CC1=C(C(=O)CC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4776088 | 181653 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 262 | 4 | 2 | 3 | 2.5 | CC1=C(C(=O)CC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 162673336 | 183143 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 290 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC2CCCC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4795209 | 183143 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 290 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC2CCCC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 11811761 | 56548 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -8 | 4 | ChEMBL | 415 | 7 | 1 | 8 | 3.7 | CCCCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL163968 | 56548 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -8 | 4 | ChEMBL | 415 | 7 | 1 | 8 | 3.7 | CCCCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 10927693 | 56749 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -3 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164281 | 56749 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | -3 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11661440 | 79851 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 1 | 3 | ChEMBL | 407 | 7 | 4 | 7 | -0.1 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCC(=O)O)cc3)nc2c1=O | 10.1021/jm060277v | |||
| CHEMBL212217 | 79851 | None | 0 | Human | Binding | pKi | = | 7 | 7.0 | 1 | 3 | ChEMBL | 407 | 7 | 4 | 7 | -0.1 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCC(=O)O)cc3)nc2c1=O | 10.1021/jm060277v | |||
| 44390615 | 122627 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(C(F)(F)F)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL360366 | 122627 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(C(F)(F)F)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 136002185 | 168178 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 480 | 9 | 2 | 10 | 1.8 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cn4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL433235 | 168178 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | - | 1 | ChEMBL | 480 | 9 | 2 | 10 | 1.8 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cn4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 137640212 | 156964 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 274 | 3 | 2 | 5 | 1.2 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1ccoc1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4072891 | 156964 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 274 | 3 | 2 | 5 | 1.2 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1ccoc1 | 10.1021/acs.jmedchem.7b00138 | |||
| 11567017 | 79951 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -1 | 3 | ChEMBL | 377 | 4 | 2 | 7 | 0.3 | CC(C)NS(=O)(=O)c1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm060277v | |||
| CHEMBL212626 | 79951 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -1 | 3 | ChEMBL | 377 | 4 | 2 | 7 | 0.3 | CC(C)NS(=O)(=O)c1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm060277v | |||
| 11821203 | 203095 | None | 5 | Human | Binding | pKi | = | 5.0 | 5.0 | -6 | 5 | ChEMBL | 256 | 2 | 1 | 5 | 0.5 | Cn1c(=O)n(Cc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL63944 | 203095 | None | 5 | Human | Binding | pKi | = | 5.0 | 5.0 | -6 | 5 | ChEMBL | 256 | 2 | 1 | 5 | 0.5 | Cn1c(=O)n(Cc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 11821203 | 203095 | None | 5 | Rat | Binding | pKi | = | 5.0 | 5.0 | -6 | 5 | ChEMBL | 256 | 2 | 1 | 5 | 0.5 | Cn1c(=O)n(Cc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL63944 | 203095 | None | 5 | Rat | Binding | pKi | = | 5.0 | 5.0 | -6 | 5 | ChEMBL | 256 | 2 | 1 | 5 | 0.5 | Cn1c(=O)n(Cc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 9928335 | 120095 | None | 2 | Rat | Binding | pKi | = | 6.0 | 6.0 | -28 | 6 | ChEMBL | 349 | 4 | 1 | 3 | 3.3 | Cc1ccc(N2CCN(CC[C@H]3NC(=O)c4ccccc43)CC2)cc1C | 10.1016/s0960-894x(98)00252-2 | |||
| CHEMBL35093 | 120095 | None | 2 | Rat | Binding | pKi | = | 6.0 | 6.0 | -28 | 6 | ChEMBL | 349 | 4 | 1 | 3 | 3.3 | Cc1ccc(N2CCN(CC[C@H]3NC(=O)c4ccccc43)CC2)cc1C | 10.1016/s0960-894x(98)00252-2 | |||
| 135493272 | 111455 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 465 | 8 | 3 | 9 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(O)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32757 | 111455 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 465 | 8 | 3 | 9 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(O)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135464144 | 112995 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -5623 | 4 | ChEMBL | 322 | 5 | 1 | 6 | 3.0 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(OC)cc3)nn12 | 10.1021/jm010570p | |||
| CHEMBL331111 | 112995 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -5623 | 4 | ChEMBL | 322 | 5 | 1 | 6 | 3.0 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(OC)cc3)nn12 | 10.1021/jm010570p | |||
| 156017083 | 177677 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2ccno2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4641788 | 177677 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2ccno2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 5.0 | 5.0 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| 162668237 | 182503 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 306 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCC2CCC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4786993 | 182503 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 306 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCC2CCC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 46837564 | 10589 | None | 1 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 418 | 7 | 3 | 5 | 3.1 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1169970 | 10589 | None | 1 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 418 | 7 | 3 | 5 | 3.1 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| 52948915 | 19293 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 33 | 2 | ChEMBL | 541 | 9 | 2 | 5 | 6.0 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290437 | 19293 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 33 | 2 | ChEMBL | 541 | 9 | 2 | 5 | 6.0 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccc(F)cc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 44406556 | 134359 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 14 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(OC)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL371731 | 134359 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 14 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(OC)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 162663910 | 182055 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 246 | 3 | 2 | 3 | 1.9 | CC1=C(C(=O)C2CC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4781313 | 182055 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 246 | 3 | 2 | 3 | 1.9 | CC1=C(C(=O)C2CC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL5070276 | 214228 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -16 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(Nc2ccccc2)nc1-c1ccccc1F | 10.1021/acs.jmedchem.1c01636 | |||||
| 10175278 | 170382 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 588 | 9 | 2 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL444787 | 170382 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 588 | 9 | 2 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10175278 | 170382 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 588 | 9 | 2 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL444787 | 170382 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 588 | 9 | 2 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)nc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 127034213 | 139125 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 273 | 3 | 1 | 6 | 2.3 | CCOC(=O)C1=C(C)Nc2nccn2C1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3786936 | 139125 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 273 | 3 | 1 | 6 | 2.3 | CCOC(=O)C1=C(C)Nc2nccn2C1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| 44520941 | 202028 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -275 | 4 | ChEMBL | 309 | 4 | 2 | 6 | 2.0 | Cc1ccc(-c2cc(C(=O)NCc3ccccn3)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| CHEMBL608383 | 202028 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -275 | 4 | ChEMBL | 309 | 4 | 2 | 6 | 2.0 | Cc1ccc(-c2cc(C(=O)NCc3ccccn3)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| 127043828 | 141123 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -1 | 7 | ChEMBL | 538 | 15 | 0 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3827331 | 141123 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -1 | 7 | ChEMBL | 538 | 15 | 0 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 9901260 | 190087 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -40 | 4 | ChEMBL | 310 | 3 | 1 | 7 | 2.3 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL517278 | 190087 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -40 | 4 | ChEMBL | 310 | 3 | 1 | 7 | 2.3 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 168297723 | 192450 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3cccc(N=C=S)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5208506 | 192450 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3cccc(N=C=S)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 162664587 | 182059 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 292 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC2CCC2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4781342 | 182059 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 292 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC2CCC2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 44583035 | 172739 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 7 | 4 | ChEMBL | 593 | 5 | 1 | 10 | 3.4 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)nc2n(C)c1=O | 10.1021/jm900413e | |||
| CHEMBL450826 | 172739 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 7 | 4 | ChEMBL | 593 | 5 | 1 | 10 | 3.4 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)nc2n(C)c1=O | 10.1021/jm900413e | |||
| 9821879 | 94982 | None | 14 | Human | Binding | pKi | = | 8.0 | 8.0 | 6 | 4 | ChEMBL | 392 | 7 | 1 | 7 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL254725 | 94982 | None | 14 | Human | Binding | pKi | = | 8.0 | 8.0 | 6 | 4 | ChEMBL | 392 | 7 | 1 | 7 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 21958593 | 155499 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 14 | 4 | ChEMBL | 368 | 5 | 2 | 6 | 1.9 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL404131 | 155499 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 14 | 4 | ChEMBL | 368 | 5 | 2 | 6 | 1.9 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 44451254 | 156887 | None | 10 | Human | Binding | pKi | = | 8.0 | 8.0 | 912 | 2 | ChEMBL | 592 | 5 | 1 | 9 | 4.0 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL407204 | 156887 | None | 10 | Human | Binding | pKi | = | 8.0 | 8.0 | 912 | 2 | ChEMBL | 592 | 5 | 1 | 9 | 4.0 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11952559 | 6307 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 194 | 3 | ChEMBL | 293 | 2 | 1 | 6 | 2.0 | Cn1c(=O)[nH]c2nc(-c3ccco3)c(-c3ccncn3)cc21 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1081841 | 6307 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 194 | 3 | ChEMBL | 293 | 2 | 1 | 6 | 2.0 | Cn1c(=O)[nH]c2nc(-c3ccco3)c(-c3ccncn3)cc21 | 10.1016/j.bmcl.2010.01.077 | |||
| 16070335 | 58016 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 28 | 3 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccccn2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672620 | 58016 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 28 | 3 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccccn2)n1)C1CC1 | 10.1021/ml100249e | |||
| 16071897 | 58026 | None | 1 | Human | Binding | pKi | = | 8.0 | 8.0 | 120 | 2 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2ccncc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672630 | 58026 | None | 1 | Human | Binding | pKi | = | 8.0 | 8.0 | 120 | 2 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2ccncc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 44588471 | 174714 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 10 | 2 | ChEMBL | 343 | 5 | 3 | 6 | 2.4 | CCCn1c(=O)c2[nH]c(-c3ccc(O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL455999 | 174714 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 10 | 2 | ChEMBL | 343 | 5 | 3 | 6 | 2.4 | CCCn1c(=O)c2[nH]c(-c3ccc(O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 24827442 | 95759 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 22 | 4 | ChEMBL | 460 | 6 | 1 | 7 | 3.5 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL258499 | 95759 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 22 | 4 | ChEMBL | 460 | 6 | 1 | 7 | 3.5 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| 22266778 | 95760 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 38 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL258507 | 95760 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 38 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 21916419 | 95973 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 8 | 4 | ChEMBL | 376 | 5 | 1 | 7 | 1.7 | Cn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL259524 | 95973 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 8 | 4 | ChEMBL | 376 | 5 | 1 | 7 | 1.7 | Cn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc21 | 10.1021/jm7014815 | |||
| 9821879 | 94982 | None | 14 | Human | Binding | pKi | = | 8.0 | 8.0 | 6 | 4 | ChEMBL | 392 | 7 | 1 | 7 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL254725 | 94982 | None | 14 | Human | Binding | pKi | = | 8.0 | 8.0 | 6 | 4 | ChEMBL | 392 | 7 | 1 | 7 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 876881 | 182404 | None | 2 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4785606 | 182404 | None | 2 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 11677724 | 140688 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 499 | 10 | 2 | 7 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC#N)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL381540 | 140688 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 3 | 2 | ChEMBL | 499 | 10 | 2 | 7 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC#N)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44450930 | 95814 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 26 | 2 | ChEMBL | 518 | 6 | 1 | 7 | 2.9 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(C(=O)c5ccc(F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258810 | 95814 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 26 | 2 | ChEMBL | 518 | 6 | 1 | 7 | 2.9 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(C(=O)c5ccc(F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 155527939 | 171259 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)[C@@H](c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4460214 | 171259 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)[C@@H](c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 127031266 | 139063 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3786336 | 139063 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 127031266 | 139063 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3786336 | 139063 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 127031266 | 139063 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3786336 | 139063 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 136042346 | 71172 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 2 | ChEMBL | 461 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955924 | 71172 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 2 | ChEMBL | 461 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44574191 | 189408 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 11 | 2 | ChEMBL | 473 | 4 | 1 | 7 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL513135 | 189408 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 11 | 2 | ChEMBL | 473 | 4 | 1 | 7 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 145971798 | 164491 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 14 | 4 | ChEMBL | 631 | 10 | 3 | 7 | 4.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4214450 | 164491 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 14 | 4 | ChEMBL | 631 | 10 | 3 | 7 | 4.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 44185873 | 192485 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 31 | 3 | ChEMBL | 510 | 6 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL520899 | 192485 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 31 | 3 | ChEMBL | 510 | 6 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 45268867 | 196180 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 12 | 3 | ChEMBL | 519 | 11 | 2 | 9 | 2.8 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL561364 | 196180 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 12 | 3 | ChEMBL | 519 | 11 | 2 | 9 | 2.8 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11519021 | 141353 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 223 | 2 | ChEMBL | 504 | 9 | 2 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)OCC)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL383638 | 141353 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 223 | 2 | ChEMBL | 504 | 9 | 2 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)OCC)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451073 | 157568 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 553 | 9 | 1 | 7 | 3.7 | O=C(COc1ccc(-c2cc3c([nH]2)c(=O)n(CC2CC2)c(=O)n3CC2CC2)cc1)N1CCN(c2ccccc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL408048 | 157568 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 553 | 9 | 1 | 7 | 3.7 | O=C(COc1ccc(-c2cc3c([nH]2)c(=O)n(CC2CC2)c(=O)n3CC2CC2)cc1)N1CCN(c2ccccc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 168297138 | 192239 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(OS(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5205220 | 192239 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(OS(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 11781054 | 206419 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 3 | ChEMBL | 284 | 4 | 2 | 4 | 1.9 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL8789 | 206419 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 3 | ChEMBL | 284 | 4 | 2 | 4 | 1.9 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm0310030 | |||
| 11781054 | 206419 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 3 | ChEMBL | 284 | 4 | 2 | 4 | 1.9 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL8789 | 206419 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 3 | ChEMBL | 284 | 4 | 2 | 4 | 1.9 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm011049y | |||
| 44281700 | 111439 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 12 | 2 | ChEMBL | 480 | 7 | 3 | 6 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Nc4cccc(Cl)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32751 | 111439 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 12 | 2 | ChEMBL | 480 | 7 | 3 | 6 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Nc4cccc(Cl)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 137631671 | 156331 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -53 | 2 | ChEMBL | 352 | 5 | 1 | 5 | 3.9 | CCCn1c(-c2cccc(OC)c2)nc2nc(C3CCCC3)[nH]c2c1=O | 10.1016/j.bmc.2017.02.029 | |||
| CHEMBL4065762 | 156331 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -53 | 2 | ChEMBL | 352 | 5 | 1 | 5 | 3.9 | CCCn1c(-c2cccc(OC)c2)nc2nc(C3CCCC3)[nH]c2c1=O | 10.1016/j.bmc.2017.02.029 | |||
| 127043828 | 141123 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -13 | 7 | ChEMBL | 538 | 15 | 0 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3827331 | 141123 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -13 | 7 | ChEMBL | 538 | 15 | 0 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 135424850 | 78280 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 378 | 6 | 1 | 7 | 2.6 | CCCn1c(=O)c2nc(-c3ccnn3-c3ccccc3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210738 | 78280 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 378 | 6 | 1 | 7 | 2.6 | CCCn1c(=O)c2nc(-c3ccnn3-c3ccccc3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 2895908 | 44286 | None | 14 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1517366 | 44286 | None | 14 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 2895908 | 44286 | None | 14 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccsc1 | 10.1021/ml400185v | |||
| CHEMBL1517366 | 44286 | None | 14 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccsc1 | 10.1021/ml400185v | |||
| 156014646 | 177231 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 337 | 3 | 2 | 6 | 3.0 | CC1=C(C(=O)OC(C)C)C(c2cc[nH]n2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4635701 | 177231 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 337 | 3 | 2 | 6 | 3.0 | CC1=C(C(=O)OC(C)C)C(c2cc[nH]n2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 135529398 | 118276 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 2 | ChEMBL | 600 | 12 | 2 | 11 | 3.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccc([N+](=O)[O-])cc5)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL34097 | 118276 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 2 | ChEMBL | 600 | 12 | 2 | 11 | 3.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccc([N+](=O)[O-])cc5)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 22266763 | 72821 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 20 | 3 | ChEMBL | 493 | 8 | 1 | 9 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccccc5Cl)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200154 | 72821 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 20 | 3 | ChEMBL | 493 | 8 | 1 | 9 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccccc5Cl)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 169317 | 1200 | None | 38 | Human | Binding | pKi | = | 6.0 | 6.0 | -44 | 9 | ChEMBL | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 427 | 1200 | None | 38 | Human | Binding | pKi | = | 6.0 | 6.0 | -44 | 9 | ChEMBL | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| CHEMBL157655 | 1200 | None | 38 | Human | Binding | pKi | = | 6.0 | 6.0 | -44 | 9 | ChEMBL | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 176408 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| 403 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| 431 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL17127 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| 176408 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| 403 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| 431 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| CHEMBL17127 | 3555 | None | 84 | Human | Binding | pKi | = | 6.0 | 6.0 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| 13525063 | 9383 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | - | 1 | ChEMBL | 300 | 2 | 2 | 6 | 0.3 | Cn1c(=O)c2nc(-c3ccccc3C(=O)O)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL11146 | 9383 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | - | 1 | ChEMBL | 300 | 2 | 2 | 6 | 0.3 | Cn1c(=O)c2nc(-c3ccccc3C(=O)O)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 10769581 | 36758 | None | 1 | Human | Binding | pKi | = | 6.0 | 6.0 | -4 | 4 | ChEMBL | 579 | 4 | 1 | 8 | 4.8 | Nc1nc2nn(CCc3cc(Br)c(Br)cc3Br)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL144972 | 36758 | None | 1 | Human | Binding | pKi | = | 6.0 | 6.0 | -4 | 4 | ChEMBL | 579 | 4 | 1 | 8 | 4.8 | Nc1nc2nn(CCc3cc(Br)c(Br)cc3Br)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 9949541 | 96290 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -107 | 4 | ChEMBL | 334 | 3 | 2 | 7 | 2.4 | Nc1nc(-c2ccco2)c2ncn(C(=O)NCc3ccccc3)c2n1 | 10.1021/jm4011669 | |||
| CHEMBL261203 | 96290 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -107 | 4 | ChEMBL | 334 | 3 | 2 | 7 | 2.4 | Nc1nc(-c2ccco2)c2ncn(C(=O)NCc3ccccc3)c2n1 | 10.1021/jm4011669 | |||
| 44390522 | 64475 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5C)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181400 | 64475 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5C)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 52950027 | 19141 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 2 | ChEMBL | 478 | 9 | 2 | 4 | 5.3 | O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289461 | 19141 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 2 | ChEMBL | 478 | 9 | 2 | 4 | 5.3 | O=C(COc1ccc2[nH]c(=O)c(-c3ccco3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 162677300 | 183536 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 275 | 2 | 2 | 4 | 2.8 | CC1=C(c2ncc(C)o2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4800081 | 183536 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 275 | 2 | 2 | 4 | 2.8 | CC1=C(c2ncc(C)o2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 145981370 | 166729 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -2 | 4 | ChEMBL | 595 | 17 | 1 | 10 | 3.3 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4283160 | 166729 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -2 | 4 | ChEMBL | 595 | 17 | 1 | 10 | 3.3 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 52941597 | 19090 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | - | 1 | ChEMBL | 357 | 5 | 1 | 4 | 2.7 | COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289109 | 19090 | None | 0 | Human | Binding | pKi | = | 5.0 | 5.0 | - | 1 | ChEMBL | 357 | 5 | 1 | 4 | 2.7 | COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 21874634 | 190086 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -9 | 4 | ChEMBL | 294 | 3 | 1 | 9 | 0.9 | Nc1nc(-c2ccco2)c2nnn(Cc3cnccn3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL517277 | 190086 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -9 | 4 | ChEMBL | 294 | 3 | 1 | 9 | 0.9 | Nc1nc(-c2ccco2)c2nnn(Cc3cnccn3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL5087059 | 215066 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -3 | 4 | ChEMBL | None | None | None | Nc1nc(-c2ccccc2)c2c(n1)-c1ccc(OCCCN3CCCCC3)cc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||||
| 46837702 | 10590 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 487 | 7 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1169971 | 10590 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 487 | 7 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| 5053422 | 203550 | None | 42 | Human | Binding | pKi | = | 4.9 | 4.9 | -1 | 3 | ChEMBL | 296 | 3 | 0 | 6 | 1.3 | C=CCn1c(=O)c2c(nc(-c3ccccc3)n2C)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL66610 | 203550 | None | 42 | Human | Binding | pKi | = | 4.9 | 4.9 | -1 | 3 | ChEMBL | 296 | 3 | 0 | 6 | 1.3 | C=CCn1c(=O)c2c(nc(-c3ccccc3)n2C)n(C)c1=O | 10.1021/jm0104318 | |||
| 11638790 | 142479 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 346 | 5 | 1 | 8 | 3.3 | COc1ccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)cn1 | 10.1021/jm061333v | |||
| CHEMBL389040 | 142479 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 346 | 5 | 1 | 8 | 3.3 | COc1ccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)cn1 | 10.1021/jm061333v | |||
| 44588470 | 174712 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 2 | ChEMBL | 343 | 5 | 2 | 7 | 2.4 | CCCn1c(=O)c2c(cc(-c3ccc(O)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL455998 | 174712 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 2 | ChEMBL | 343 | 5 | 2 | 7 | 2.4 | CCCn1c(=O)c2c(cc(-c3ccc(O)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 76309933 | 103854 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 278 | 3 | 1 | 4 | 2.2 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1C | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091715 | 103854 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 278 | 3 | 1 | 4 | 2.2 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1C | 10.1021/acs.jmedchem.0c01431 | |||
| 76309933 | 103854 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 278 | 3 | 1 | 4 | 2.2 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1C | 10.1021/ml400185v | |||
| CHEMBL3091715 | 103854 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 278 | 3 | 1 | 4 | 2.2 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1C | 10.1021/ml400185v | |||
| 9955052 | 119881 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 4 | ChEMBL | 442 | 3 | 2 | 8 | 4.2 | Cn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL349019 | 119881 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 4 | ChEMBL | 442 | 3 | 2 | 8 | 4.2 | Cn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11565927 | 85368 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 317 | 4 | 1 | 8 | 2.7 | c1coc(-c2nc(Nc3cnccn3)ncc2-c2ccncn2)c1 | 10.1021/jm061333v | |||
| CHEMBL226188 | 85368 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 317 | 4 | 1 | 8 | 2.7 | c1coc(-c2nc(Nc3cnccn3)ncc2-c2ccncn2)c1 | 10.1021/jm061333v | |||
| 46228011 | 200175 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 2 | 3 | ChEMBL | 364 | 6 | 1 | 6 | 2.5 | CCCn1c(=O)c2[nH]c(Cc3ccccc3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL596558 | 200175 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 2 | 3 | ChEMBL | 364 | 6 | 1 | 6 | 2.5 | CCCn1c(=O)c2[nH]c(Cc3ccccc3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 155548797 | 173735 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 393 | 3 | 1 | 6 | 4.5 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4536469 | 173735 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 393 | 3 | 1 | 6 | 4.5 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 21874756 | 190793 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -117 | 4 | ChEMBL | 335 | 4 | 2 | 8 | 2.3 | CCc1cc(Cn2nnc3c(-c4ccco4)nc(N)nc32)ccc1N | 10.1021/jm800961g | |||
| CHEMBL518364 | 190793 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -117 | 4 | ChEMBL | 335 | 4 | 2 | 8 | 2.3 | CCc1cc(Cn2nnc3c(-c4ccco4)nc(N)nc32)ccc1N | 10.1021/jm800961g | |||
| 10436433 | 131371 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -30 | 3 | ChEMBL | 512 | 9 | 5 | 15 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL368880 | 131371 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -30 | 3 | ChEMBL | 512 | 9 | 5 | 15 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 44410554 | 140869 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -346 | 4 | ChEMBL | 511 | 7 | 5 | 12 | 0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4cccc([N+](=O)[O-])c4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL381972 | 140869 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -346 | 4 | ChEMBL | 511 | 7 | 5 | 12 | 0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4cccc([N+](=O)[O-])c4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 3481963 | 38085 | None | 7 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 294 | 4 | 2 | 4 | 2.6 | CC1=C(C(=O)OCC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1460793 | 38085 | None | 7 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 294 | 4 | 2 | 4 | 2.6 | CC1=C(C(=O)OCC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 16720104 | 85260 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 386 | 6 | 1 | 8 | 3.5 | O=c1ccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)cn1CC1CC1 | 10.1021/jm061333v | |||
| CHEMBL225982 | 85260 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 386 | 6 | 1 | 8 | 3.5 | O=c1ccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)cn1CC1CC1 | 10.1021/jm061333v | |||
| 71680890 | 90213 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -2 | 6 | ChEMBL | 322 | 4 | 1 | 4 | 3.7 | O=C(C/C=C/c1ccccc1)Nc1nc2ccccc2c(=O)s1 | 10.1021/jm400336x | |||
| CHEMBL2382438 | 90213 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -2 | 6 | ChEMBL | 322 | 4 | 1 | 4 | 3.7 | O=C(C/C=C/c1ccccc1)Nc1nc2ccccc2c(=O)s1 | 10.1021/jm400336x | |||
| 162669248 | 182607 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4788318 | 182607 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 135443367 | 487 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 382 | 487 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 135493279 | 100380 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 5 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL289903 | 100380 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 5 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135522375 | 114255 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 525 | 11 | 2 | 11 | 2.1 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33305 | 114255 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 525 | 11 | 2 | 11 | 2.1 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135443367 | 487 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 382 | 487 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 135493279 | 100380 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 5 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL289903 | 100380 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 5 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135522375 | 114255 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 525 | 11 | 2 | 11 | 2.1 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33305 | 114255 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 525 | 11 | 2 | 11 | 2.1 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10926253 | 81056 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 353 | 2 | 1 | 10 | 0.6 | CN1CCN(c2c3c(nc(N)n4nc(-c5ccco5)nc34)nn2C)CC1 | 10.1021/jm021023m | |||
| CHEMBL21541 | 81056 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 353 | 2 | 1 | 10 | 0.6 | CN1CCN(c2c3c(nc(N)n4nc(-c5ccco5)nc34)nn2C)CC1 | 10.1021/jm021023m | |||
| CHEMBL553587 | 81056 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 353 | 2 | 1 | 10 | 0.6 | CN1CCN(c2c3c(nc(N)n4nc(-c5ccco5)nc34)nn2C)CC1 | 10.1021/jm021023m | |||
| 10852375 | 37549 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -15 | 4 | ChEMBL | 309 | 3 | 1 | 8 | 2.3 | CC(C)=CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL145623 | 37549 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -15 | 4 | ChEMBL | 309 | 3 | 1 | 8 | 2.3 | CC(C)=CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 44236850 | 156152 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 582 | 8 | 1 | 9 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4063759 | 156152 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 582 | 8 | 1 | 9 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCN(c5cccc(C(F)(F)F)c5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 57429608 | 156663 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 470 | 5 | 1 | 7 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(F)(F)F)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4069518 | 156663 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 470 | 5 | 1 | 7 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(F)(F)F)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44236506 | 159438 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 474 | 7 | 1 | 9 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccccc4C(=O)OC)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4101147 | 159438 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 474 | 7 | 1 | 9 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccccc4C(=O)OC)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 66892867 | 156317 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 27 | 3 | ChEMBL | 479 | 7 | 1 | 8 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4065629 | 156317 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 27 | 3 | ChEMBL | 479 | 7 | 1 | 8 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 66892710 | 157534 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 475 | 8 | 1 | 8 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(C)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4080098 | 157534 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 475 | 8 | 1 | 8 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(C)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 22266742 | 94565 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 431 | 6 | 2 | 8 | 2.6 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251880 | 94565 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 431 | 6 | 2 | 8 | 2.6 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 16072024 | 58014 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 3 | ChEMBL | 348 | 5 | 1 | 5 | 4.3 | O=C(CC1CCCC1)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| CHEMBL1672618 | 58014 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 3 | ChEMBL | 348 | 5 | 1 | 5 | 4.3 | O=C(CC1CCCC1)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| 50940964 | 57276 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -3 | 4 | ChEMBL | 269 | 3 | 1 | 5 | 3.0 | CC(=O)Nc1cc(-c2ccco2)nc(-c2ccco2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650384 | 57276 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -3 | 4 | ChEMBL | 269 | 3 | 1 | 5 | 3.0 | CC(=O)Nc1cc(-c2ccco2)nc(-c2ccco2)n1 | 10.1021/jm100843z | |||
| 136042329 | 71153 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 41 | 2 | ChEMBL | 534 | 10 | 2 | 11 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)OCC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955904 | 71153 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 41 | 2 | ChEMBL | 534 | 10 | 2 | 11 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)OCC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135493279 | 100380 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 5 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL289903 | 100380 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 5 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135874420 | 161300 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL412284 | 161300 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 52946453 | 19221 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 2 | ChEMBL | 521 | 9 | 2 | 5 | 5.6 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290001 | 19221 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 2 | ChEMBL | 521 | 9 | 2 | 5 | 5.6 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NC1(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11720113 | 74230 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 490 | 10 | 2 | 7 | 4.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL202358 | 74230 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 490 | 10 | 2 | 7 | 4.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 3909843 | 138970 | None | 14 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3785290 | 138970 | None | 14 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.0c00564 | |||
| 3909843 | 138970 | None | 14 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785290 | 138970 | None | 14 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| 3909843 | 138970 | None | 14 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3785290 | 138970 | None | 14 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| 155545585 | 173454 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 19 | 3 | ChEMBL | 568 | 10 | 3 | 9 | 1.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OCCO)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4529435 | 173454 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 19 | 3 | ChEMBL | 568 | 10 | 3 | 9 | 1.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OCCO)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 11561073 | 74754 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 13 | 2 | ChEMBL | 432 | 7 | 2 | 6 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203088 | 74754 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 13 | 2 | ChEMBL | 432 | 7 | 2 | 6 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11693081 | 138425 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 2 | ChEMBL | 637 | 14 | 3 | 8 | 5.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)NCCc5ccc(OC)cc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL377434 | 138425 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 2 | ChEMBL | 637 | 14 | 3 | 8 | 5.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)NCCc5ccc(OC)cc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44450931 | 96035 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 64 | 2 | ChEMBL | 472 | 5 | 1 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259869 | 96035 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 64 | 2 | ChEMBL | 472 | 5 | 1 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11525776 | 73409 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 21 | 2 | ChEMBL | 475 | 9 | 2 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C)cn4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201595 | 73409 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 21 | 2 | ChEMBL | 475 | 9 | 2 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C)cn4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11548559 | 74235 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 556 | 9 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)c(Br)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL202359 | 74235 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 2 | ChEMBL | 556 | 9 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)c(Br)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 449 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 453 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 6603931 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL273807 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 449 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 453 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 6603931 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| CHEMBL273807 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 136414902 | 159712 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 3 | ChEMBL | 560 | 9 | 1 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4104450 | 159712 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 3 | ChEMBL | 560 | 9 | 1 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 449 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0104318 | |||
| 453 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0104318 | |||
| 6603931 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0104318 | |||
| CHEMBL273807 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.9 | 7.9 | -9 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm0104318 | |||
| 46228006 | 199696 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 3 | ChEMBL | 364 | 5 | 0 | 7 | 2.1 | CCn1c(=O)c2c(nc(Cc3ccccc3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL593217 | 199696 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 3 | ChEMBL | 364 | 5 | 0 | 7 | 2.1 | CCn1c(=O)c2c(nc(Cc3ccccc3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 137647216 | 157777 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 423 | 7 | 1 | 8 | 1.7 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4082841 | 157777 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 423 | 7 | 1 | 8 | 1.7 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 22266753 | 96795 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 260 | 2 | 2 | 6 | -0.2 | CCn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL264952 | 96795 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 260 | 2 | 2 | 6 | -0.2 | CCn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 46228003 | 200016 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 3 | 3 | ChEMBL | 356 | 5 | 1 | 7 | 2.2 | CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL595431 | 200016 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 3 | 3 | ChEMBL | 356 | 5 | 1 | 7 | 2.2 | CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 11381738 | 195046 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -19 | 4 | ChEMBL | 324 | 5 | 2 | 6 | 2.3 | COc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)c1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL549477 | 195046 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -19 | 4 | ChEMBL | 324 | 5 | 2 | 6 | 2.3 | COc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)c1 | 10.1016/j.bmcl.2009.03.142 | |||
| 10918042 | 120082 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -4 | 4 | ChEMBL | 494 | 6 | 2 | 8 | 4.9 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL350830 | 120082 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -4 | 4 | ChEMBL | 494 | 6 | 2 | 8 | 4.9 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 44406398 | 72982 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 30 | 3 | ChEMBL | 527 | 8 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccccc5C(F)(F)F)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200739 | 72982 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 30 | 3 | ChEMBL | 527 | 8 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccccc5C(F)(F)F)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 9805713 | 162844 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | -2238 | 6 | ChEMBL | 493 | 5 | 4 | 8 | 1.3 | OC[C@@]12C[C@@H]1[C@@H](n1cnc3c(NCc4cccc(I)c4)ncnc31)[C@H](O)[C@@H]2O | 10.1021/jm9905965 | |||
| CHEMBL417292 | 162844 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | -2238 | 6 | ChEMBL | 493 | 5 | 4 | 8 | 1.3 | OC[C@@]12C[C@@H]1[C@@H](n1cnc3c(NCc4cccc(I)c4)ncnc31)[C@H](O)[C@@H]2O | 10.1021/jm9905965 | |||
| 135522362 | 100019 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286838 | 100019 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11531253 | 77363 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -4 | 3 | ChEMBL | 391 | 6 | 2 | 7 | 0.7 | CCCCNS(=O)(=O)c1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm060277v | |||
| CHEMBL208550 | 77363 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -4 | 3 | ChEMBL | 391 | 6 | 2 | 7 | 0.7 | CCCCNS(=O)(=O)c1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm060277v | |||
| 21874685 | 188894 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -64 | 4 | ChEMBL | 292 | 3 | 1 | 7 | 2.1 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL507426 | 188894 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -64 | 4 | ChEMBL | 292 | 3 | 1 | 7 | 2.1 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3)c2n1 | 10.1021/jm800961g | |||
| 44406570 | 72846 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 18 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(OC)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200230 | 72846 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 18 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(OC)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 9857735 | 189825 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -61 | 4 | ChEMBL | 307 | 3 | 2 | 8 | 1.7 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3N)c2n1 | 10.1021/jm800961g | |||
| CHEMBL516483 | 189825 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -61 | 4 | ChEMBL | 307 | 3 | 2 | 8 | 1.7 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3N)c2n1 | 10.1021/jm800961g | |||
| 11503979 | 73404 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 482 | 7 | 2 | 7 | 2.6 | COc1cc(OCC(=O)NCc2ccc(Cl)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL201580 | 73404 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 482 | 7 | 2 | 7 | 2.6 | COc1cc(OCC(=O)NCc2ccc(Cl)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 11645609 | 141042 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 33 | 2 | ChEMBL | 329 | 4 | 2 | 6 | 0.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL382413 | 141042 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 33 | 2 | ChEMBL | 329 | 4 | 2 | 6 | 0.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44452535 | 155770 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -38 | 4 | ChEMBL | 295 | 4 | 2 | 7 | 1.9 | OCCNc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL405868 | 155770 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -38 | 4 | ChEMBL | 295 | 4 | 2 | 7 | 1.9 | OCCNc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 45273122 | 195767 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -128 | 4 | ChEMBL | 308 | 4 | 2 | 5 | 2.6 | Cc1ccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)cc1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL557696 | 195767 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -128 | 4 | ChEMBL | 308 | 4 | 2 | 5 | 2.6 | Cc1ccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)cc1 | 10.1016/j.bmcl.2009.03.142 | |||
| 136044108 | 129690 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 344 | 5 | 3 | 7 | 1.8 | CCCn1c(=O)c2nc(-c3cccc(O)c3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL36740 | 129690 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -3 | 2 | ChEMBL | 344 | 5 | 3 | 7 | 1.8 | CCCn1c(=O)c2nc(-c3cccc(O)c3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 11059351 | 119943 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -6 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccccc3OC)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL349611 | 119943 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -6 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccccc3OC)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 45268920 | 196684 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 334 | 6 | 1 | 7 | 1.7 | CCn1c(=O)c2[nH]c(-c3cccs3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL564680 | 196684 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 2 | ChEMBL | 334 | 6 | 1 | 7 | 1.7 | CCn1c(=O)c2[nH]c(-c3cccs3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 46228002 | 201443 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 4 | 2 | ChEMBL | 340 | 5 | 1 | 7 | 1.7 | CCn1c(=O)c2[nH]c(Cc3ccco3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL604896 | 201443 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 4 | 2 | ChEMBL | 340 | 5 | 1 | 7 | 1.7 | CCn1c(=O)c2[nH]c(Cc3ccco3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 11582537 | 169299 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -2 | 3 | ChEMBL | 420 | 7 | 1 | 7 | 3.1 | CC(C)Cn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL441530 | 169299 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -2 | 3 | ChEMBL | 420 | 7 | 1 | 7 | 3.1 | CC(C)Cn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm051268+ | |||
| 54577823 | 80995 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | -30 | 5 | ChEMBL | 289 | 2 | 0 | 7 | 0.1 | Cn1c(=O)c2c(nc3n2CCCN3CC2CC2)n(C)c1=O | 10.1016/j.ejmech.2011.05.023 | |||
| CHEMBL2153627 | 80995 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | -30 | 5 | ChEMBL | 289 | 2 | 0 | 7 | 0.1 | Cn1c(=O)c2c(nc3n2CCCN3CC2CC2)n(C)c1=O | 10.1016/j.ejmech.2011.05.023 | |||
| 70696537 | 75448 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1 | 2 | ChEMBL | 304 | 7 | 3 | 5 | 1.8 | COc1cccc2cc(C(=O)NCCCCCO)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042075 | 75448 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1 | 2 | ChEMBL | 304 | 7 | 3 | 5 | 1.8 | COc1cccc2cc(C(=O)NCCCCCO)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 145987354 | 167161 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -5 | 4 | ChEMBL | 609 | 18 | 1 | 10 | 3.6 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4291015 | 167161 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -5 | 4 | ChEMBL | 609 | 18 | 1 | 10 | 3.6 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN(CC)CC)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 44410566 | 141377 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1071 | 4 | ChEMBL | 496 | 7 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4cccc(OC)c4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL383836 | 141377 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -1071 | 4 | ChEMBL | 496 | 7 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4cccc(OC)c4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 10311510 | 123570 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -25 | 4 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5OC)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL361826 | 123570 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -25 | 4 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5OC)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 10311510 | 123570 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -25 | 4 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5OC)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL361826 | 123570 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -25 | 4 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5OC)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 9954406 | 96698 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -31 | 3 | ChEMBL | 430 | 9 | 2 | 6 | 3.6 | CCCn1c(=O)c2nc([C@]34CC[C@](CCCC(=O)O)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL264070 | 96698 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -31 | 3 | ChEMBL | 430 | 9 | 2 | 6 | 3.6 | CCCn1c(=O)c2nc([C@]34CC[C@](CCCC(=O)O)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 5.9 | 5.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm701594y | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 5.9 | 5.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm701594y | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 5.9 | 5.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm701594y | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 5.9 | 5.9 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm701594y | |||
| 10431614 | 58129 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -14 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL167753 | 58129 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -14 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 44406582 | 72883 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 7 | 3 | ChEMBL | 474 | 8 | 1 | 10 | 3.0 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(C)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200350 | 72883 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 7 | 3 | ChEMBL | 474 | 8 | 1 | 10 | 3.0 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(C)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 21874721 | 178585 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -58 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3cc(F)ccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL467245 | 178585 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -58 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3cc(F)ccc3F)c2n1 | 10.1021/jm800961g | |||
| 21874639 | 178651 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -3 | 4 | ChEMBL | 311 | 3 | 2 | 8 | 0.8 | Nc1nc(-c2cnn[nH]2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL467655 | 178651 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -3 | 4 | ChEMBL | 311 | 3 | 2 | 8 | 0.8 | Nc1nc(-c2cnn[nH]2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 11282829 | 206009 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -1 | 3 | ChEMBL | 471 | 7 | 2 | 9 | 2.2 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4cccc([N+](=O)[O-])c4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL8495 | 206009 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -1 | 3 | ChEMBL | 471 | 7 | 2 | 9 | 2.2 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4cccc([N+](=O)[O-])c4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| 135443378 | 109635 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccccc5C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32229 | 109635 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccccc5C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135443378 | 109635 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccccc5C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32229 | 109635 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5ccccc5C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 57429602 | 157237 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4076435 | 157237 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2021.113907 | |||
| 44236568 | 156468 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4067401 | 156468 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 69028196 | 159561 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 491 | 9 | 1 | 9 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4102641 | 159561 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 491 | 9 | 1 | 9 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 21958783 | 94591 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 85 | 2 | ChEMBL | 364 | 5 | 2 | 6 | 2.0 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252068 | 94591 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 85 | 2 | ChEMBL | 364 | 5 | 2 | 6 | 2.0 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 22266766 | 155469 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 498 | 6 | 2 | 9 | 2.8 | O=c1[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL403975 | 155469 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 498 | 6 | 2 | 9 | 2.8 | O=c1[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| 10308937 | 155498 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 9 | 3 | ChEMBL | 350 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL404130 | 155498 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 9 | 3 | ChEMBL | 350 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 11952665 | 6048 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 19 | 3 | ChEMBL | 262 | 2 | 1 | 4 | 3.3 | c1coc(-c2nc3[nH]ccc3cc2-c2ccncn2)c1 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1080512 | 6048 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 19 | 3 | ChEMBL | 262 | 2 | 1 | 4 | 3.3 | c1coc(-c2nc3[nH]ccc3cc2-c2ccncn2)c1 | 10.1016/j.bmcl.2010.01.077 | |||
| 53318744 | 58012 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 4 | ChEMBL | 334 | 4 | 1 | 5 | 3.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CCCC1 | 10.1021/ml100249e | |||
| CHEMBL1672616 | 58012 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 4 | ChEMBL | 334 | 4 | 1 | 5 | 3.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CCCC1 | 10.1021/ml100249e | |||
| 11690561 | 78300 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 3 | ChEMBL | 432 | 5 | 1 | 7 | 2.9 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL210808 | 78300 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 3 | ChEMBL | 432 | 5 | 1 | 7 | 2.9 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm7014815 | |||
| 21958583 | 96243 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 7 | 4 | ChEMBL | 382 | 5 | 1 | 7 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL260976 | 96243 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 7 | 4 | ChEMBL | 382 | 5 | 1 | 7 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 9930130 | 10799 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 387 | 5 | 1 | 5 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171897 | 10799 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 387 | 5 | 1 | 5 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49798140 | 10868 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 3 | ChEMBL | 484 | 9 | 1 | 7 | 3.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N(C)CCOC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172442 | 10868 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 2 | 3 | ChEMBL | 484 | 9 | 1 | 7 | 3.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N(C)CCOC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 11690561 | 78300 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 3 | ChEMBL | 432 | 5 | 1 | 7 | 2.9 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210808 | 78300 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 34 | 3 | ChEMBL | 432 | 5 | 1 | 7 | 2.9 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm051268+ | |||
| 10970525 | 99945 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 3 | ChEMBL | 364 | 4 | 3 | 5 | 2.3 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc4cc(C(=O)O)ccc4c3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL286350 | 99945 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 3 | ChEMBL | 364 | 4 | 3 | 5 | 2.3 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc4cc(C(=O)O)ccc4c3)nc2c1=O | 10.1021/jm011049y | |||
| 44451252 | 95974 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 12 | 2 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1ccc(N2CCN(C(=O)COc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259529 | 95974 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 12 | 2 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1ccc(N2CCN(C(=O)COc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| 44451050 | 95985 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 23 | 2 | ChEMBL | 501 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259581 | 95985 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 23 | 2 | ChEMBL | 501 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 168292492 | 191638 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(S(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5195884 | 191638 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(S(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 10377463 | 96311 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -2 | 4 | ChEMBL | 251 | 1 | 1 | 6 | 2.1 | Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL261345 | 96311 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -2 | 4 | ChEMBL | 251 | 1 | 1 | 6 | 2.1 | Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 136042347 | 71173 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 2 | ChEMBL | 482 | 9 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955925 | 71173 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 2 | ChEMBL | 482 | 9 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11525368 | 73386 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 2 | ChEMBL | 457 | 7 | 2 | 7 | 3.1 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(CC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201496 | 73386 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 2 | ChEMBL | 457 | 7 | 2 | 7 | 3.1 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(CC)c1=O | 10.1021/jm0506221 | |||
| 44450929 | 95813 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 85 | 2 | ChEMBL | 544 | 9 | 2 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(O)(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258809 | 95813 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 85 | 2 | ChEMBL | 544 | 9 | 2 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(O)(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44451491 | 96674 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 30 | 2 | ChEMBL | 475 | 5 | 1 | 9 | 0.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ncccn5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL263895 | 96674 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 30 | 2 | ChEMBL | 475 | 5 | 1 | 9 | 0.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ncccn5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 69032552 | 157953 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 491 | 9 | 1 | 9 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(OC)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4084707 | 157953 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 491 | 9 | 1 | 9 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(OC)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 155562321 | 175844 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2[C@@H]1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4585472 | 175844 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2[C@@H]1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11720513 | 73025 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 517 | 10 | 3 | 7 | 4.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(NC(C)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL200967 | 73025 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 4 | 2 | ChEMBL | 517 | 10 | 3 | 7 | 4.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(NC(C)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11561715 | 73399 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 2 | ChEMBL | 462 | 9 | 2 | 7 | 2.7 | COCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc21 | 10.1021/jm0506221 | |||
| CHEMBL201554 | 73399 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 8 | 2 | ChEMBL | 462 | 9 | 2 | 7 | 2.7 | COCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc21 | 10.1021/jm0506221 | |||
| 46228018 | 199833 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 7 | 3 | ChEMBL | 354 | 5 | 0 | 8 | 1.7 | CCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594271 | 199833 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 7 | 3 | ChEMBL | 354 | 5 | 0 | 8 | 1.7 | CCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 44574282 | 178780 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 432 | 6 | 2 | 6 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL468920 | 178780 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 432 | 6 | 2 | 6 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL5080757 | 214702 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -2 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccc(F)cc2)nc(N)nc1-c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 135416055 | 110480 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 5 | 2 | ChEMBL | 517 | 8 | 2 | 8 | 3.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32478 | 110480 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 5 | 2 | ChEMBL | 517 | 8 | 2 | 8 | 3.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(C(F)(F)F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 57429611 | 159550 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 446 | 6 | 2 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(=O)O)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4102581 | 159550 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 446 | 6 | 2 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(=O)O)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 11733601 | 119987 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -5 | 4 | ChEMBL | 484 | 6 | 2 | 8 | 5.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL349954 | 119987 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -5 | 4 | ChEMBL | 484 | 6 | 2 | 8 | 5.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 22283414 | 10661 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 3 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1170518 | 10661 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 3 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 22283414 | 10661 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 3 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170518 | 10661 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 3 | ChEMBL | 359 | 4 | 2 | 5 | 3.7 | COc1ccc(NC(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 9869857 | 66828 | None | 11 | Human | Binding | pKi | = | 5.9 | 5.9 | -109 | 4 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL186113 | 66828 | None | 11 | Human | Binding | pKi | = | 5.9 | 5.9 | -109 | 4 | ChEMBL | 482 | 8 | 5 | 14 | -0.6 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 71300326 | 118499 | None | 40 | Human | Binding | pKi | = | 5.9 | 5.9 | 2 | 3 | ChEMBL | 499 | 6 | 2 | 4 | 3.0 | O=C([C@@H](Cc1cccc(C(F)(F)F)c1)NS(=O)(=O)c1cc(F)c2c(c1)CCNC2)N1CCCC1 | 10.6019/CHEMBL5212743 | |||
| CHEMBL3414622 | 118499 | None | 40 | Human | Binding | pKi | = | 5.9 | 5.9 | 2 | 3 | ChEMBL | 499 | 6 | 2 | 4 | 3.0 | O=C([C@@H](Cc1cccc(C(F)(F)F)c1)NS(=O)(=O)c1cc(F)c2c(c1)CCNC2)N1CCCC1 | 10.6019/CHEMBL5212743 | |||
| CHEMBL4789678 | 118499 | None | 40 | Human | Binding | pKi | = | 5.9 | 5.9 | 2 | 3 | ChEMBL | 499 | 6 | 2 | 4 | 3.0 | O=C([C@@H](Cc1cccc(C(F)(F)F)c1)NS(=O)(=O)c1cc(F)c2c(c1)CCNC2)N1CCCC1 | 10.6019/CHEMBL5212743 | |||
| 44520983 | 201236 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -380 | 4 | ChEMBL | 326 | 5 | 2 | 7 | 1.8 | CCn1ccnc1CNC(=O)c1cc(-c2ccc(C)o2)nc(N)n1 | 10.1016/j.bmc.2009.07.078 | |||
| CHEMBL603748 | 201236 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -380 | 4 | ChEMBL | 326 | 5 | 2 | 7 | 1.8 | CCn1ccnc1CNC(=O)c1cc(-c2ccc(C)o2)nc(N)n1 | 10.1016/j.bmc.2009.07.078 | |||
| 127043669 | 141176 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 4 | ChEMBL | 439 | 9 | 1 | 8 | 3.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3828002 | 141176 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 1 | 4 | ChEMBL | 439 | 9 | 1 | 8 | 3.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 44406403 | 72985 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 26 | 2 | ChEMBL | 489 | 9 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5cccc(OC)c5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200747 | 72985 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 26 | 2 | ChEMBL | 489 | 9 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5cccc(OC)c5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11577210 | 74592 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 518 | 10 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)OCC)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL202980 | 74592 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 518 | 10 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)OCC)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 168292492 | 191638 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(S(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5195884 | 191638 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(S(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 135465796 | 110568 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 18 | 2 | ChEMBL | 571 | 9 | 2 | 9 | 3.4 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32534 | 110568 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 18 | 2 | ChEMBL | 571 | 9 | 2 | 9 | 3.4 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| 10938276 | 119875 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -29 | 4 | ChEMBL | 402 | 4 | 2 | 8 | 3.7 | CCn1cc2c(nc(NC(=O)Nc3ccc(C)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL348975 | 119875 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -29 | 4 | ChEMBL | 402 | 4 | 2 | 8 | 3.7 | CCn1cc2c(nc(NC(=O)Nc3ccc(C)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 21874626 | 190674 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -12 | 4 | ChEMBL | 335 | 4 | 2 | 8 | 1.2 | NC(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL518178 | 190674 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -12 | 4 | ChEMBL | 335 | 4 | 2 | 8 | 1.2 | NC(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 22995178 | 100008 | None | 4 | Human | Binding | pKi | = | 5.9 | 5.9 | 3 | 3 | ChEMBL | 232 | 4 | 1 | 5 | 0.3 | C=CCn1c(=O)c2nc[nH]c2n(CC=C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL286785 | 100008 | None | 4 | Human | Binding | pKi | = | 5.9 | 5.9 | 3 | 3 | ChEMBL | 232 | 4 | 1 | 5 | 0.3 | C=CCn1c(=O)c2nc[nH]c2n(CC=C)c1=O | 10.1021/jm0104318 | |||
| 1908 | 205999 | None | 33 | Human | Binding | pKi | = | 5.9 | 5.9 | 1 | 6 | ChEMBL | 336 | 2 | 2 | 7 | -0.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL8488 | 205999 | None | 33 | Human | Binding | pKi | = | 5.9 | 5.9 | 1 | 6 | ChEMBL | 336 | 2 | 2 | 7 | -0.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 1908 | 205999 | None | 33 | Human | Binding | pKi | = | 5.9 | 5.9 | 1 | 6 | ChEMBL | 336 | 2 | 2 | 7 | -0.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm0310030 | |||
| CHEMBL8488 | 205999 | None | 33 | Human | Binding | pKi | = | 5.9 | 5.9 | 1 | 6 | ChEMBL | 336 | 2 | 2 | 7 | -0.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm0310030 | |||
| 1908 | 205999 | None | 33 | Human | Binding | pKi | = | 5.9 | 5.9 | 1 | 6 | ChEMBL | 336 | 2 | 2 | 7 | -0.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| CHEMBL8488 | 205999 | None | 33 | Human | Binding | pKi | = | 5.9 | 5.9 | 1 | 6 | ChEMBL | 336 | 2 | 2 | 7 | -0.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| 46880471 | 6075 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 10 | 2 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(-c2cocn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1080677 | 6075 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 10 | 2 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(-c2cocn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 44406625 | 72818 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 22 | 3 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5cccc(Cl)c5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200146 | 72818 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 22 | 3 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5cccc(Cl)c5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 21874538 | 169440 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -11 | 4 | ChEMBL | 333 | 3 | 2 | 9 | 1.4 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]nnc4c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL442670 | 169440 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -11 | 4 | ChEMBL | 333 | 3 | 2 | 9 | 1.4 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]nnc4c3)c2n1 | 10.1021/jm800961g | |||
| 46233379 | 200337 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 416 | 5 | 0 | 7 | 2.9 | CCn1c(=O)c2c(nc(Cc3c(F)cccc3F)n2C)n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL597560 | 200337 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 416 | 5 | 0 | 7 | 2.9 | CCn1c(=O)c2c(nc(Cc3c(F)cccc3F)n2C)n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 44437219 | 90649 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | -1 | 2 | ChEMBL | 340 | 3 | 0 | 8 | 0.3 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccn2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| CHEMBL239018 | 90649 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | -1 | 2 | ChEMBL | 340 | 3 | 0 | 8 | 0.3 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccn2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| 24894016 | 64479 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 297 | 2 | 3 | 5 | 2.5 | O=C(Nc1ccc(O)c(O)c1)c1coc2ccccc2c1=O | 10.1016/j.ejmech.2012.05.033 | |||
| CHEMBL1814066 | 64479 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | - | 1 | ChEMBL | 297 | 2 | 3 | 5 | 2.5 | O=C(Nc1ccc(O)c(O)c1)c1coc2ccccc2c1=O | 10.1016/j.ejmech.2012.05.033 | |||
| 11133843 | 57455 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -5 | 4 | ChEMBL | 434 | 6 | 2 | 8 | 4.3 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165620 | 57455 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -5 | 4 | ChEMBL | 434 | 6 | 2 | 8 | 4.3 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 10994317 | 57092 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -8 | 4 | ChEMBL | 470 | 5 | 2 | 8 | 4.8 | CCCn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164509 | 57092 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -8 | 4 | ChEMBL | 470 | 5 | 2 | 8 | 4.8 | CCCn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 44406588 | 133533 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 6 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5cccc(OC)c5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL370860 | 133533 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 6 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5cccc(OC)c5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 45267990 | 196102 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -53 | 4 | ChEMBL | 328 | 4 | 2 | 5 | 2.9 | Nc1nc(C(=O)NCc2ccccc2Cl)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL560904 | 196102 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -53 | 4 | ChEMBL | 328 | 4 | 2 | 5 | 2.9 | Nc1nc(C(=O)NCc2ccccc2Cl)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 136044107 | 131222 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 344 | 5 | 3 | 7 | 1.8 | CCCn1c(=O)c2nc(-c3cc(O)ccc3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL36867 | 131222 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -2 | 3 | ChEMBL | 344 | 5 | 3 | 7 | 1.8 | CCCn1c(=O)c2nc(-c3cc(O)ccc3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 162666539 | 182288 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 276 | 4 | 2 | 4 | 1.9 | CC1=C(C(=O)OCC2CC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4783992 | 182288 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 276 | 4 | 2 | 4 | 1.9 | CC1=C(C(=O)OCC2CC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 45272308 | 195345 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 3 | 2 | ChEMBL | 318 | 6 | 1 | 7 | 1.2 | CCn1c(=O)c2[nH]c(-c3ccco3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL551761 | 195345 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 3 | 2 | ChEMBL | 318 | 6 | 1 | 7 | 1.2 | CCn1c(=O)c2[nH]c(-c3ccco3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 46233315 | 200384 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 4 | 4 | ChEMBL | 372 | 5 | 1 | 7 | 2.7 | CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL597955 | 200384 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 4 | 4 | ChEMBL | 372 | 5 | 1 | 7 | 2.7 | CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 164622009 | 186087 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -309 | 2 | ChEMBL | 426 | 8 | 4 | 9 | 0.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.ejmech.2021.113607 | |||
| CHEMBL4871554 | 186087 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -309 | 2 | ChEMBL | 426 | 8 | 4 | 9 | 0.6 | CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.ejmech.2021.113607 | |||
| 1882 | 90650 | None | 66 | Human | Binding | pKi | = | 5.9 | 5.9 | 3 | 5 | ChEMBL | 242 | 2 | 0 | 6 | -0.3 | Cn1c(=O)c2c(ncn2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL23903 | 90650 | None | 66 | Human | Binding | pKi | = | 5.9 | 5.9 | 3 | 5 | ChEMBL | 242 | 2 | 0 | 6 | -0.3 | Cn1c(=O)c2c(ncn2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 439176 | 98619 | None | 71 | Human | Binding | pKi | = | 4.9 | 4.9 | -54 | 4 | ChEMBL | 297 | 3 | 3 | 9 | -0.6 | CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm031092g | |||
| CHEMBL277041 | 98619 | None | 71 | Human | Binding | pKi | = | 4.9 | 4.9 | -54 | 4 | ChEMBL | 297 | 3 | 3 | 9 | -0.6 | CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm031092g | |||
| 44236632 | 158666 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 441 | 6 | 1 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C#N)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4092863 | 158666 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 441 | 6 | 1 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C#N)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 69031810 | 158854 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 545 | 9 | 1 | 9 | 4.0 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4094895 | 158854 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 545 | 9 | 1 | 9 | 4.0 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11654460 | 94557 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 4 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251869 | 94557 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 4 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 9890439 | 94558 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 10 | 4 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251870 | 94558 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 10 | 4 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 22266775 | 94618 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 29 | 4 | ChEMBL | 459 | 8 | 1 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252245 | 94618 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 29 | 4 | ChEMBL | 459 | 8 | 1 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 22266741 | 155078 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 500 | 6 | 2 | 9 | 3.1 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL401834 | 155078 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 500 | 6 | 2 | 9 | 3.1 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 46880510 | 6155 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 11 | 3 | ChEMBL | 316 | 4 | 1 | 4 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccncc2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081041 | 6155 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 11 | 3 | ChEMBL | 316 | 4 | 1 | 4 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccncc2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 135874416 | 96386 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 35 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(F)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261809 | 96386 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 35 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(F)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 44406611 | 72751 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 40 | 3 | ChEMBL | 485 | 8 | 1 | 11 | 2.5 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(C#N)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL199895 | 72751 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 40 | 3 | ChEMBL | 485 | 8 | 1 | 11 | 2.5 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(C#N)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 22266775 | 94618 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 29 | 4 | ChEMBL | 459 | 8 | 1 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL252245 | 94618 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 29 | 4 | ChEMBL | 459 | 8 | 1 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11654460 | 94557 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 4 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL251869 | 94557 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 4 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm7014815 | |||
| 9890439 | 94558 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 10 | 4 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL251870 | 94558 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 10 | 4 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm7014815 | |||
| 11568203 | 96242 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 28 | 4 | ChEMBL | 432 | 5 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL260975 | 96242 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 28 | 4 | ChEMBL | 432 | 5 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 49797772 | 10854 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 466 | 7 | 1 | 6 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN4CCCC4=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172276 | 10854 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 1 | 3 | ChEMBL | 466 | 7 | 1 | 6 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN4CCCC4=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 11654460 | 94557 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 4 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL251869 | 94557 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 3 | 4 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 9890439 | 94558 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 10 | 4 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL251870 | 94558 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 10 | 4 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 136042331 | 71155 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 48 | 2 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C)cccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955906 | 71155 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 48 | 2 | ChEMBL | 476 | 8 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C)cccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11670078 | 72778 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 474 | 9 | 2 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199999 | 72778 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | - | 1 | ChEMBL | 474 | 9 | 2 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL5086487 | 215032 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | -5 | 3 | ChEMBL | None | None | None | CCNc1nc(-c2ccccc2)c(C#N)c(-c2cccc(C#N)c2)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 136042351 | 71149 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 53 | 2 | ChEMBL | 492 | 9 | 2 | 10 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955900 | 71149 | None | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 53 | 2 | ChEMBL | 492 | 9 | 2 | 10 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44450828 | 157693 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 44 | 2 | ChEMBL | 472 | 6 | 1 | 6 | 3.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL408185 | 157693 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 44 | 2 | ChEMBL | 472 | 6 | 1 | 6 | 3.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 11089092 | 139784 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 4 | 3 | ChEMBL | 340 | 5 | 3 | 5 | 1.6 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(/C=C/C(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37987 | 139784 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 4 | 3 | ChEMBL | 340 | 5 | 3 | 5 | 1.6 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(/C=C/C(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL5071174 | 214250 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -6 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(Nc2ccccc2)nc1-c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 11038429 | 119493 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 502 | 8 | 2 | 7 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL34543 | 119493 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 502 | 8 | 2 | 7 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 44451049 | 160180 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 74 | 2 | ChEMBL | 535 | 7 | 1 | 7 | 3.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL410934 | 160180 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 74 | 2 | ChEMBL | 535 | 7 | 1 | 7 | 3.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 46228058 | 200056 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 12 | 3 | ChEMBL | 384 | 6 | 0 | 8 | 2.6 | CCCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL595658 | 200056 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 12 | 3 | ChEMBL | 384 | 6 | 0 | 8 | 2.6 | CCCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 136042328 | 71145 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 10 | 2 | ChEMBL | 507 | 9 | 2 | 11 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc([N+](=O)[O-])ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955894 | 71145 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 10 | 2 | ChEMBL | 507 | 9 | 2 | 11 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc([N+](=O)[O-])ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11586663 | 72067 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 229 | 1 | 1 | 7 | 0.4 | Cc1cc2c(nc(-n3nccn3)n2C)c(N)n1 | 10.1021/jm058018d | |||
| CHEMBL197682 | 72067 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -1 | 3 | ChEMBL | 229 | 1 | 1 | 7 | 0.4 | Cc1cc2c(nc(-n3nccn3)n2C)c(N)n1 | 10.1021/jm058018d | |||
| 137660519 | 159408 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 437 | 7 | 1 | 8 | 2.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4100823 | 159408 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 437 | 7 | 1 | 8 | 2.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 137645935 | 157574 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -354 | 4 | ChEMBL | 446 | 6 | 1 | 8 | 3.5 | COc1cnc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4080594 | 157574 | None | 0 | Human | Binding | pKi | = | 5.9 | 5.9 | -354 | 4 | ChEMBL | 446 | 6 | 1 | 8 | 3.5 | COc1cnc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)cc3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 44308394 | 102633 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | - | 1 | ChEMBL | 224 | 2 | 0 | 7 | -1.0 | COCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL304319 | 102633 | None | 0 | Human | Binding | pKi | = | 4.9 | 4.9 | - | 1 | ChEMBL | 224 | 2 | 0 | 7 | -1.0 | COCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| 22266744 | 96390 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 2 | 3 | ChEMBL | 302 | 4 | 2 | 6 | 1.0 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cn[nH]c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL261817 | 96390 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 2 | 3 | ChEMBL | 302 | 4 | 2 | 6 | 1.0 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cn[nH]c3)nc21 | 10.1021/jm7014815 | |||
| 9923269 | 96028 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -75 | 4 | ChEMBL | 324 | 3 | 2 | 8 | 2.0 | Nc1nc(-c2ccco2)c2ncn(C(=O)NCc3ccco3)c2n1 | 10.1021/jm4011669 | |||
| CHEMBL259832 | 96028 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -75 | 4 | ChEMBL | 324 | 3 | 2 | 8 | 2.0 | Nc1nc(-c2ccco2)c2ncn(C(=O)NCc3ccco3)c2n1 | 10.1021/jm4011669 | |||
| 11720443 | 140649 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 5 | 2 | ChEMBL | 512 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4F)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL381473 | 140649 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | 5 | 2 | ChEMBL | 512 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4F)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 168281755 | 190903 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(OS(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5185103 | 190903 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(OS(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 10884265 | 57408 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -588 | 4 | ChEMBL | 418 | 3 | 2 | 10 | 2.6 | Cn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165224 | 57408 | None | 0 | Human | Binding | pKi | = | 6.9 | 6.9 | -588 | 4 | ChEMBL | 418 | 3 | 2 | 10 | 2.6 | Cn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 76011 | 203655 | None | 8 | Rat | Binding | pKi | = | 4.9 | 4.9 | -2 | 3 | ChEMBL | 256 | 3 | 0 | 6 | 0.1 | Cn1c(=O)c2c(ncn2CCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL67323 | 203655 | None | 8 | Rat | Binding | pKi | = | 4.9 | 4.9 | -2 | 3 | ChEMBL | 256 | 3 | 0 | 6 | 0.1 | Cn1c(=O)c2c(ncn2CCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 11784369 | 119923 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -4 | 4 | ChEMBL | 401 | 6 | 1 | 8 | 3.3 | CCCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL349464 | 119923 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -4 | 4 | ChEMBL | 401 | 6 | 1 | 8 | 3.3 | CCCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11683855 | 72600 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 2 | ChEMBL | 452 | 6 | 2 | 7 | 2.4 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccc(F)cc1 | 10.1021/jm0506221 | |||
| CHEMBL199353 | 72600 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 2 | ChEMBL | 452 | 6 | 2 | 7 | 2.4 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccc(F)cc1 | 10.1021/jm0506221 | |||
| 44452454 | 95952 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 3 | 4 | ChEMBL | 332 | 4 | 0 | 7 | 3.7 | c1coc(-c2nc3c(OCc4ccoc4)nc4ccccc4n3n2)c1 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL259430 | 95952 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 3 | 4 | ChEMBL | 332 | 4 | 0 | 7 | 3.7 | c1coc(-c2nc3c(OCc4ccoc4)nc4ccccc4n3n2)c1 | 10.1016/j.bmc.2007.10.103 | |||
| 44316331 | 205497 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -97 | 3 | ChEMBL | 468 | 11 | 4 | 6 | 4.8 | Oc1ccc(C[C@@H]2CCCN2CCCCCCN2CCC[C@H]2Cc2ccc(O)c(O)c2)cc1O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL80686 | 205497 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -97 | 3 | ChEMBL | 468 | 11 | 4 | 6 | 4.8 | Oc1ccc(C[C@@H]2CCCN2CCCCCCN2CCC[C@H]2Cc2ccc(O)c(O)c2)cc1O | 10.1016/0960-894X(95)00413-N | |||
| 24812771 | 175705 | None | 4 | Human | Binding | pKi | = | 6.8 | 6.8 | -16 | 5 | ChEMBL | 344 | 5 | 1 | 7 | 1.9 | COC[C@H]1CCCN1c1cc(NC(C)=O)nc(-n2nc(C)cc2C)n1 | 10.1021/jm800908d | |||
| CHEMBL458224 | 175705 | None | 4 | Human | Binding | pKi | = | 6.8 | 6.8 | -16 | 5 | ChEMBL | 344 | 5 | 1 | 7 | 1.9 | COC[C@H]1CCCN1c1cc(NC(C)=O)nc(-n2nc(C)cc2C)n1 | 10.1021/jm800908d | |||
| 44390527 | 64545 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(F)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181468 | 64545 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(F)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 44442167 | 154882 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -204 | 3 | ChEMBL | 602 | 8 | 5 | 11 | 2.3 | CC1(C)c2ccc(C(=O)NCCc3ccc(Nc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2C(C)(C)N1[O] | 10.1016/j.bmcl.2007.07.035 | |||
| CHEMBL400746 | 154882 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -204 | 3 | ChEMBL | 602 | 8 | 5 | 11 | 2.3 | CC1(C)c2ccc(C(=O)NCCc3ccc(Nc4ncnc5c4ncn5[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)cc3)cc2C(C)(C)N1[O] | 10.1016/j.bmcl.2007.07.035 | |||
| 217940 | 203477 | None | 28 | Human | Binding | pKi | = | 4.8 | 4.8 | - | 1 | ChEMBL | 219 | 1 | 0 | 7 | -1.0 | Cn1c(=O)c2c(ncn2CC#N)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL66058 | 203477 | None | 28 | Human | Binding | pKi | = | 4.8 | 4.8 | - | 1 | ChEMBL | 219 | 1 | 0 | 7 | -1.0 | Cn1c(=O)c2c(ncn2CC#N)n(C)c1=O | 10.1021/jm0104318 | |||
| 45268928 | 196144 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 331 | 7 | 2 | 6 | 1.3 | CCCn1c(=O)c2[nH]c(-c3ccc[nH]3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL561168 | 196144 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 331 | 7 | 2 | 6 | 1.3 | CCCn1c(=O)c2[nH]c(-c3ccc[nH]3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11711754 | 72601 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 434 | 6 | 2 | 7 | 2.3 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccccc1 | 10.1021/jm0506221 | |||
| CHEMBL199354 | 72601 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 434 | 6 | 2 | 7 | 2.3 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccccc1 | 10.1021/jm0506221 | |||
| 127026188 | 138083 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -1348 | 5 | ChEMBL | 329 | 3 | 2 | 5 | 2.7 | Nc1nc(C(=O)NCc2cccc3cccnc23)c2ccccc2n1 | 10.1016/j.bmcl.2015.11.048 | |||
| CHEMBL3765818 | 138083 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -1348 | 5 | ChEMBL | 329 | 3 | 2 | 5 | 2.7 | Nc1nc(C(=O)NCc2cccc3cccnc23)c2ccccc2n1 | 10.1016/j.bmcl.2015.11.048 | |||
| 76320870 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3091699 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 76320870 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL3091699 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 76320870 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091699 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 76320870 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/ml400185v | |||
| CHEMBL3091699 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/ml400185v | |||
| 76320870 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3091699 | 103841 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 135443367 | 487 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 382 | 487 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 135443367 | 487 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 382 | 487 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 10.1021/jm0309654 | |||
| 135915276 | 158619 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 451 | 7 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC#Cc4ccc(F)cc4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4092291 | 158619 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 451 | 7 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC#Cc4ccc(F)cc4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 22266761 | 94553 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 229 | 2 | ChEMBL | 418 | 6 | 2 | 9 | 1.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccccc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251854 | 94553 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 229 | 2 | ChEMBL | 418 | 6 | 2 | 9 | 1.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccccc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 22266751 | 94566 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 497 | 6 | 2 | 8 | 3.4 | O=c1[nH]c2nc(-c3cnn(Cc4cc(-c5ccc(C(F)(F)F)cc5)on4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251881 | 94566 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 497 | 6 | 2 | 8 | 3.4 | O=c1[nH]c2nc(-c3cnn(Cc4cc(-c5ccc(C(F)(F)F)cc5)on4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| 22266776 | 166513 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 93 | 2 | ChEMBL | 486 | 6 | 2 | 9 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL427887 | 166513 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 93 | 2 | ChEMBL | 486 | 6 | 2 | 9 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 135874413 | 96388 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccccc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261810 | 96388 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 22 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccccc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 49797793 | 10852 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 11 | 3 | ChEMBL | 427 | 6 | 1 | 7 | 3.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)OC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172274 | 10852 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 11 | 3 | ChEMBL | 427 | 6 | 1 | 7 | 3.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)OC)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 137638964 | 156860 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 288 | 3 | 2 | 5 | 1.6 | CC1=C(C(=O)OC(C)C)[C@@H](c2ccco2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4071734 | 156860 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 288 | 3 | 2 | 5 | 1.6 | CC1=C(C(=O)OC(C)C)[C@@H](c2ccco2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 10882425 | 79167 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 13 | 4 | ChEMBL | 342 | 6 | 3 | 5 | 1.5 | CCCCn1c(=O)[nH]c2nc(-c3ccc(CC(=O)O)cc3)[nH]c2c1=O | 10.1021/jm011049y | |||
| CHEMBL2113345 | 79167 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 13 | 4 | ChEMBL | 342 | 6 | 3 | 5 | 1.5 | CCCCn1c(=O)[nH]c2nc(-c3ccc(CC(=O)O)cc3)[nH]c2c1=O | 10.1021/jm011049y | |||
| 11611298 | 139221 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 412 | 5 | 2 | 9 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4nncs4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL378815 | 139221 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 412 | 5 | 2 | 9 | 1.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4nncs4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451048 | 95984 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 15 | 3 | ChEMBL | 519 | 7 | 1 | 7 | 3.0 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259580 | 95984 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 15 | 3 | ChEMBL | 519 | 7 | 1 | 7 | 3.0 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 155511376 | 169553 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@@H](C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4435630 | 169553 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@@H](C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 45272259 | 195641 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 10 | 2 | ChEMBL | 478 | 10 | 2 | 9 | 2.0 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccn4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL556389 | 195641 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 10 | 2 | ChEMBL | 478 | 10 | 2 | 9 | 2.0 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccn4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 45269711 | 196341 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 11 | 3 | ChEMBL | 493 | 10 | 3 | 9 | 2.3 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(O)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL562427 | 196341 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 11 | 3 | ChEMBL | 493 | 10 | 3 | 9 | 2.3 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(O)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11660995 | 72810 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 7 | 2 | ChEMBL | 385 | 8 | 2 | 6 | 2.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL200112 | 72810 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 7 | 2 | ChEMBL | 385 | 8 | 2 | 6 | 2.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 136042352 | 71150 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 17 | 2 | ChEMBL | 540 | 8 | 2 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955901 | 71150 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 17 | 2 | ChEMBL | 540 | 8 | 2 | 9 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 9910158 | 32448 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -10 | 6 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL141154 | 32448 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -10 | 6 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 9910158 | 32448 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -10 | 6 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL141154 | 32448 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -10 | 6 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 11080788 | 56758 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -7 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3cccc(OC)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164325 | 56758 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -7 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3cccc(OC)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11733556 | 120015 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -10 | 4 | ChEMBL | 480 | 5 | 2 | 8 | 4.6 | CCCn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL350205 | 120015 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -10 | 4 | ChEMBL | 480 | 5 | 2 | 8 | 4.6 | CCCn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11780616 | 203609 | None | 5 | Human | Binding | pKi | = | 4.8 | 4.8 | 1 | 4 | ChEMBL | 270 | 4 | 0 | 6 | 0.5 | Cn1c(=O)c2c(ncn2CCCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL67060 | 203609 | None | 5 | Human | Binding | pKi | = | 4.8 | 4.8 | 1 | 4 | ChEMBL | 270 | 4 | 0 | 6 | 0.5 | Cn1c(=O)c2c(ncn2CCCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 2153 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| 2153 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| 2620 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| 2620 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| 413 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| 413 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| CHEMBL190 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL190 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| DB00277 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| DB00277 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| 2153 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 2620 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 413 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| CHEMBL190 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| DB00277 | 3798 | None | 115 | Rat | Binding | pKi | = | 4.8 | 4.8 | -1 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 11509299 | 72780 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | 2 | 2 | ChEMBL | 387 | 6 | 1 | 8 | 1.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1OC | 10.1021/jm0506221 | |||
| CHEMBL200012 | 72780 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | 2 | 2 | ChEMBL | 387 | 6 | 1 | 8 | 1.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1OC | 10.1021/jm0506221 | |||
| 2917279 | 181675 | None | 15 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 280 | 4 | 2 | 4 | 2.3 | CCCOC(=O)C1=C(C)NC(=O)NC1c1cccs1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4776470 | 181675 | None | 15 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 280 | 4 | 2 | 4 | 2.3 | CCCOC(=O)C1=C(C)NC(=O)NC1c1cccs1 | 10.1021/acs.jmedchem.0c01431 | |||
| 9814428 | 71495 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -45 | 4 | ChEMBL | 286 | 5 | 1 | 8 | 1.3 | CCCCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1 | 10.1021/jm058018d | |||
| CHEMBL196258 | 71495 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -45 | 4 | ChEMBL | 286 | 5 | 1 | 8 | 1.3 | CCCCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1 | 10.1021/jm058018d | |||
| 11822168 | 203654 | None | 0 | Rat | Binding | pKi | = | 4.8 | 4.8 | -6 | 4 | ChEMBL | 284 | 4 | 1 | 5 | 1.1 | Cn1c(=O)n(CCCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL67313 | 203654 | None | 0 | Rat | Binding | pKi | = | 4.8 | 4.8 | -6 | 4 | ChEMBL | 284 | 4 | 1 | 5 | 1.1 | Cn1c(=O)n(CCCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 11610869 | 80254 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -2 | 3 | ChEMBL | 393 | 5 | 3 | 8 | -1.0 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCC(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| CHEMBL213878 | 80254 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -2 | 3 | ChEMBL | 393 | 5 | 3 | 8 | -1.0 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCC(=O)O)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| 71451329 | 81017 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -5128 | 3 | ChEMBL | 372 | 5 | 1 | 7 | 1.4 | CCCn1c(=O)c2[nH]c(C3C4CC5OC(=O)C3C5C4)nc2n(CCC)c1=O | 10.1016/j.ejmech.2011.05.023 | |||
| CHEMBL2153721 | 81017 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -5128 | 3 | ChEMBL | 372 | 5 | 1 | 7 | 1.4 | CCCn1c(=O)c2[nH]c(C3C4CC5OC(=O)C3C5C4)nc2n(CCC)c1=O | 10.1016/j.ejmech.2011.05.023 | |||
| 44308307 | 102640 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | - | 1 | ChEMBL | 346 | 3 | 1 | 9 | 0.4 | Cn1c(=O)c2nc(-c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL304356 | 102640 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | - | 1 | ChEMBL | 346 | 3 | 1 | 9 | 0.4 | Cn1c(=O)c2nc(-c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 11530568 | 73360 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 359 | 5 | 2 | 7 | 0.7 | COc1cc(OCC(=O)O)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL201330 | 73360 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 359 | 5 | 2 | 7 | 0.7 | COc1cc(OCC(=O)O)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 44588437 | 175552 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 342 | 5 | 2 | 7 | 2.3 | CCCn1c(=O)c2c(cc(-c3ccc(N)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457880 | 175552 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 342 | 5 | 2 | 7 | 2.3 | CCCn1c(=O)c2c(cc(-c3ccc(N)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11393155 | 195612 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -44 | 4 | ChEMBL | 324 | 5 | 2 | 6 | 2.3 | COc1ccccc1CNC(=O)c1cc(-c2ccco2)nc(N)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL556083 | 195612 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -44 | 4 | ChEMBL | 324 | 5 | 2 | 6 | 2.3 | COc1ccccc1CNC(=O)c1cc(-c2ccco2)nc(N)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 44449635 | 155191 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -676 | 4 | ChEMBL | 262 | 2 | 0 | 6 | 2.9 | CN(C)c1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| CHEMBL402464 | 155191 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -676 | 4 | ChEMBL | 262 | 2 | 0 | 6 | 2.9 | CN(C)c1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| 155516146 | 170049 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 304 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4442922 | 170049 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 304 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 5130381 | 49068 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 296 | 3 | 2 | 5 | 2.9 | CC1=C(C(=O)OC(C)C)C(c2cccs2)NC(S)=N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1561375 | 49068 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 296 | 3 | 2 | 5 | 2.9 | CC1=C(C(=O)OC(C)C)C(c2cccs2)NC(S)=N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 162671451 | 182863 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 292 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CC2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4791727 | 182863 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 292 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CC2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 5130381 | 49068 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 296 | 3 | 2 | 5 | 2.9 | CC1=C(C(=O)OC(C)C)C(c2cccs2)NC(S)=N1 | 10.1021/ml400185v | |||
| CHEMBL1561375 | 49068 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 296 | 3 | 2 | 5 | 2.9 | CC1=C(C(=O)OC(C)C)C(c2cccs2)NC(S)=N1 | 10.1021/ml400185v | |||
| 11676113 | 73392 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 419 | 8 | 2 | 6 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201523 | 73392 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 2 | 2 | ChEMBL | 419 | 8 | 2 | 6 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 25070230 | 202437 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 4 | ChEMBL | 295 | 2 | 2 | 5 | 2.7 | Oc1cccc(-c2nc(N3CCCCC3)c3nc[nH]c3n2)c1 | 10.1016/j.bmc.2019.06.034 | |||
| CHEMBL611021 | 202437 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 4 | ChEMBL | 295 | 2 | 2 | 5 | 2.7 | Oc1cccc(-c2nc(N3CCCCC3)c3nc[nH]c3n2)c1 | 10.1016/j.bmc.2019.06.034 | |||
| 168288152 | 191828 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5198830 | 191828 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 67364057 | 74287 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 3 | ChEMBL | 295 | 2 | 1 | 5 | 2.9 | Cc1cc(-c2nnc(N)nc2-c2ccc(F)cc2)cc(C)n1 | 10.1021/jm201376w | |||
| CHEMBL2024116 | 74287 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 3 | ChEMBL | 295 | 2 | 1 | 5 | 2.9 | Cc1cc(-c2nnc(N)nc2-c2ccc(F)cc2)cc(C)n1 | 10.1021/jm201376w | |||
| 136086750 | 8719 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 349 | 3 | 4 | 6 | 1.9 | N=C1c2c(C(N)=O)nc(-c3ccccc3O)n2CN1c1ccc(O)cc1 | 10.1016/j.bmc.2010.03.048 | |||
| CHEMBL1095872 | 8719 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 349 | 3 | 4 | 6 | 1.9 | N=C1c2c(C(N)=O)nc(-c3ccccc3O)n2CN1c1ccc(O)cc1 | 10.1016/j.bmc.2010.03.048 | |||
| CHEMBL5071873 | 214268 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -20 | 3 | ChEMBL | None | None | None | Cn1cc(-c2cnc(N)n3nc(-c4nccs4)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00599 | |||||
| 135489238 | 477 | None | 1 | Human | Binding | pKi | = | 7.8 | 7.8 | 30 | 2 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| 381 | 477 | None | 1 | Human | Binding | pKi | = | 7.8 | 7.8 | 30 | 2 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| CHEMBL32802 | 477 | None | 1 | Human | Binding | pKi | = | 7.8 | 7.8 | 30 | 2 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| 135489238 | 477 | None | 1 | Human | Binding | pKi | = | 7.8 | 7.8 | 30 | 2 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| 381 | 477 | None | 1 | Human | Binding | pKi | = | 7.8 | 7.8 | 30 | 2 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| CHEMBL32802 | 477 | None | 1 | Human | Binding | pKi | = | 7.8 | 7.8 | 30 | 2 | ChEMBL | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 10.1021/jm0309654 | |||
| 66892244 | 158930 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 32 | 3 | ChEMBL | 491 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4095686 | 158930 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 32 | 3 | ChEMBL | 491 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11544506 | 85381 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 332 | 4 | 2 | 7 | 2.6 | O=c1ccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)c[nH]1 | 10.1021/jm061333v | |||
| CHEMBL226238 | 85381 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 332 | 4 | 2 | 7 | 2.6 | O=c1ccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)c[nH]1 | 10.1021/jm061333v | |||
| 24827555 | 166426 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 25 | 4 | ChEMBL | 445 | 5 | 1 | 8 | 2.6 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(-c4ccc(C(F)(F)F)nc4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL427736 | 166426 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 25 | 4 | ChEMBL | 445 | 5 | 1 | 8 | 2.6 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(-c4ccc(C(F)(F)F)nc4)c3)nc21 | 10.1021/jm7014815 | |||
| 11306173 | 166623 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 26 | 4 | ChEMBL | 480 | 7 | 1 | 10 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4nc(-c5ccc(Cl)cc5)no4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL428086 | 166623 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 26 | 4 | ChEMBL | 480 | 7 | 1 | 10 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4nc(-c5ccc(Cl)cc5)no4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 44574193 | 189248 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 61 | 2 | ChEMBL | 418 | 5 | 2 | 6 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)NCc4ccccc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL511714 | 189248 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 61 | 2 | ChEMBL | 418 | 5 | 2 | 6 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)NCc4ccccc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 11713561 | 72667 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 4 | 2 | ChEMBL | 536 | 10 | 2 | 6 | 5.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199583 | 72667 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 4 | 2 | ChEMBL | 536 | 10 | 2 | 6 | 5.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.8 | 7.8 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.8 | 7.8 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.8 | 7.8 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| CHEMBL5084815 | 214934 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | None | None | None | N#Cc1cccc(-c2nc(Nc3ccccc3)nc(-c3ccccc3)c2C#N)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 50941005 | 57278 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -2 | 4 | ChEMBL | 297 | 5 | 1 | 5 | 3.7 | CCCC(=O)Nc1cc(-c2ccco2)nc(-c2ccco2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650386 | 57278 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -2 | 4 | ChEMBL | 297 | 5 | 1 | 5 | 3.7 | CCCC(=O)Nc1cc(-c2ccco2)nc(-c2ccco2)n1 | 10.1021/jm100843z | |||
| 11524904 | 73350 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 436 | 6 | 2 | 6 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201323 | 73350 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 2 | 2 | ChEMBL | 436 | 6 | 2 | 6 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11576014 | 133005 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 450 | 8 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)n4ccc(N)n4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL370205 | 133005 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 2 | ChEMBL | 450 | 8 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)n4ccc(N)n4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451227 | 96383 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 532 | 10 | 1 | 8 | 2.4 | COCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc2n(CCOC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL261790 | 96383 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 532 | 10 | 1 | 8 | 2.4 | COCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc2n(CCOC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 135493280 | 110376 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 28 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(Cl)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32425 | 110376 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 28 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(Cl)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 9945226 | 176977 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -69 | 4 | ChEMBL | 326 | 3 | 1 | 7 | 2.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(Cl)c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL462488 | 176977 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -69 | 4 | ChEMBL | 326 | 3 | 1 | 7 | 2.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(Cl)c3)c2n1 | 10.1021/jm800961g | |||
| 10971099 | 57298 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -5 | 4 | ChEMBL | 387 | 5 | 1 | 8 | 2.9 | CCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165073 | 57298 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -5 | 4 | ChEMBL | 387 | 5 | 1 | 8 | 2.9 | CCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11732736 | 57577 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -24 | 4 | ChEMBL | 430 | 6 | 2 | 8 | 4.5 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(C)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL166684 | 57577 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -24 | 4 | ChEMBL | 430 | 6 | 2 | 8 | 4.5 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(C)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 10971841 | 57473 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -17 | 4 | ChEMBL | 420 | 5 | 2 | 8 | 3.9 | CCCn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165778 | 57473 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -17 | 4 | ChEMBL | 420 | 5 | 2 | 8 | 3.9 | CCCn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 46227994 | 199831 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 6 | 2 | ChEMBL | 350 | 5 | 1 | 6 | 2.1 | CCn1c(=O)c2[nH]c(Cc3ccccc3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594255 | 199831 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 6 | 2 | ChEMBL | 350 | 5 | 1 | 6 | 2.1 | CCn1c(=O)c2[nH]c(Cc3ccccc3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 12905388 | 91767 | None | 2 | Human | Binding | pKi | = | 5.8 | 5.8 | 3 | 5 | ChEMBL | 194 | 1 | 1 | 5 | -0.6 | CCn1c(=O)c2nc[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL24107 | 91767 | None | 2 | Human | Binding | pKi | = | 5.8 | 5.8 | 3 | 5 | ChEMBL | 194 | 1 | 1 | 5 | -0.6 | CCn1c(=O)c2nc[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 135493285 | 99770 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 492 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(N(C)C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL285151 | 99770 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 492 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(N(C)C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 22282339 | 83102 | None | 3 | Rat | Binding | pKi | = | 6.8 | 6.8 | -234 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| CHEMBL2181976 | 83102 | None | 3 | Rat | Binding | pKi | = | 6.8 | 6.8 | -234 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| CHEMBL5084951 | 83102 | None | 3 | Rat | Binding | pKi | = | 6.8 | 6.8 | -234 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| 44406397 | 72903 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 26 | 3 | ChEMBL | 493 | 8 | 1 | 9 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5cccc(Cl)c5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200417 | 72903 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 26 | 3 | ChEMBL | 493 | 8 | 1 | 9 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5cccc(Cl)c5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 9857422 | 188809 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -85 | 4 | ChEMBL | 298 | 3 | 1 | 8 | 2.2 | Nc1nc(-c2ccco2)c2nnn(Cc3ccsc3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL506101 | 188809 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -85 | 4 | ChEMBL | 298 | 3 | 1 | 8 | 2.2 | Nc1nc(-c2ccco2)c2nnn(Cc3ccsc3)c2n1 | 10.1021/jm800961g | |||
| 50940981 | 57286 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -4 | 4 | ChEMBL | 315 | 4 | 1 | 5 | 4.3 | CCC(=O)Nc1cc(-c2ccsc2)nc(-c2ccsc2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650394 | 57286 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -4 | 4 | ChEMBL | 315 | 4 | 1 | 5 | 4.3 | CCC(=O)Nc1cc(-c2ccsc2)nc(-c2ccsc2)n1 | 10.1021/jm100843z | |||
| 10928182 | 57450 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 4 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(nc(NC(=O)Nc3ccccc3OC)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165560 | 57450 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 4 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(nc(NC(=O)Nc3ccccc3OC)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11014188 | 118481 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -6 | 4 | ChEMBL | 373 | 4 | 1 | 8 | 2.5 | Cn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL341376 | 118481 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -6 | 4 | ChEMBL | 373 | 4 | 1 | 8 | 2.5 | Cn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11014188 | 118481 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -6 | 4 | ChEMBL | 373 | 4 | 1 | 8 | 2.5 | Cn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL341376 | 118481 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -6 | 4 | ChEMBL | 373 | 4 | 1 | 8 | 2.5 | Cn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 11524240 | 72596 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3cccc(OCC(=O)Nc4ccccc4)c3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199330 | 72596 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 1 | 2 | ChEMBL | 404 | 5 | 2 | 6 | 2.3 | Cn1c(=O)c2[nH]c(-c3cccc(OCC(=O)Nc4ccccc4)c3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 15578102 | 173227 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 271 | 1 | 1 | 6 | 0.9 | Cn1c(=O)c2c(cc(-c3ccccc3)n2O)n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL452359 | 173227 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 271 | 1 | 1 | 6 | 0.9 | Cn1c(=O)c2c(cc(-c3ccccc3)n2O)n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 50940976 | 57272 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -316 | 4 | ChEMBL | 391 | 4 | 1 | 7 | 3.6 | CCC(=O)Nc1cc(-c2ccc3c(c2)OCO3)nc(-c2ccc3c(c2)OCO3)n1 | 10.1021/jm100843z | |||
| CHEMBL1650380 | 57272 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -316 | 4 | ChEMBL | 391 | 4 | 1 | 7 | 3.6 | CCC(=O)Nc1cc(-c2ccc3c(c2)OCO3)nc(-c2ccc3c(c2)OCO3)n1 | 10.1021/jm100843z | |||
| 10052252 | 96629 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(OC)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL263494 | 96629 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(OC)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 44451197 | 95888 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 39 | 2 | ChEMBL | 474 | 5 | 1 | 7 | 2.2 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)N1CCc2ccccc2C1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259155 | 95888 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 39 | 2 | ChEMBL | 474 | 5 | 1 | 7 | 2.2 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)N1CCc2ccccc2C1 | 10.1016/j.bmc.2008.01.002 | |||
| 11716665 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 5617 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| CHEMBL375293 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1021/jm061333v | |||
| 11716665 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1016/j.bmcl.2010.01.045 | |||
| 5617 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL375293 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | ChEMBL | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 10.1016/j.bmcl.2010.01.045 | |||
| 155533829 | 171880 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@H](C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4469484 | 171880 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@H](C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11678808 | 73036 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 16 | 2 | ChEMBL | 600 | 11 | 2 | 8 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(S(=O)(=O)c5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201042 | 73036 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 16 | 2 | ChEMBL | 600 | 11 | 2 | 8 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(S(=O)(=O)c5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 66894039 | 156555 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 545 | 8 | 1 | 9 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(OC(F)(F)F)c5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4068331 | 156555 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 545 | 8 | 1 | 9 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(OC(F)(F)F)c5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44236657 | 156333 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(=O)O)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4065780 | 156333 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(=O)O)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 22266759 | 94564 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 451 | 6 | 2 | 8 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cc(-c5ccc(Cl)cc5)on4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251879 | 94564 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 451 | 6 | 2 | 8 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cc(-c5ccc(Cl)cc5)on4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 24950370 | 178716 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 3 | ChEMBL | 261 | 2 | 1 | 4 | 3.5 | N#Cc1c(-c2ccccc2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| CHEMBL468370 | 178716 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -15 | 3 | ChEMBL | 261 | 2 | 1 | 4 | 3.5 | N#Cc1c(-c2ccccc2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| 11067937 | 203619 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -5 | 3 | ChEMBL | 344 | 5 | 0 | 6 | 2.0 | C=CCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL67110 | 203619 | None | 0 | Rat | Binding | pKi | = | 5.8 | 5.8 | -5 | 3 | ChEMBL | 344 | 5 | 0 | 6 | 2.0 | C=CCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 9798466 | 134276 | None | 1 | Rat | Binding | pKi | = | 5.8 | 5.8 | -218 | 6 | ChEMBL | 349 | 4 | 1 | 3 | 3.3 | Cc1ccc(N2CCN(CC[C@@H]3NC(=O)c4ccccc43)CC2)cc1C | 10.1016/s0960-894x(98)00252-2 | |||
| CHEMBL37170 | 134276 | None | 1 | Rat | Binding | pKi | = | 5.8 | 5.8 | -218 | 6 | ChEMBL | 349 | 4 | 1 | 3 | 3.3 | Cc1ccc(N2CCN(CC[C@@H]3NC(=O)c4ccccc43)CC2)cc1C | 10.1016/s0960-894x(98)00252-2 | |||
| 72697932 | 104025 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | -54 | 5 | ChEMBL | 341 | 2 | 0 | 7 | 1.1 | C#CCn1c(=O)c2c(nc3n2CCCN3C2CCCCC2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093321 | 104025 | None | 0 | Human | Binding | pKi | = | 4.8 | 4.8 | -54 | 5 | ChEMBL | 341 | 2 | 0 | 7 | 1.1 | C#CCn1c(=O)c2c(nc3n2CCCN3C2CCCCC2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 9824812 | 121140 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -67 | 4 | ChEMBL | 446 | 4 | 2 | 9 | 4.1 | COc1ccc(NC(=O)Nc2nc3nn(C(C)(C)C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL357663 | 121140 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -67 | 4 | ChEMBL | 446 | 4 | 2 | 9 | 4.1 | COc1ccc(NC(=O)Nc2nc3nn(C(C)(C)C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 22446266 | 203587 | None | 2 | Human | Binding | pKi | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 236 | 4 | 1 | 5 | 0.7 | CCCCn1c(=O)c2nc[nH]c2n(CC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL66881 | 203587 | None | 2 | Human | Binding | pKi | = | 5.8 | 5.8 | 1 | 2 | ChEMBL | 236 | 4 | 1 | 5 | 0.7 | CCCCn1c(=O)c2nc[nH]c2n(CC)c1=O | 10.1021/jm0104318 | |||
| 45273118 | 196469 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 1 | 4 | ChEMBL | 520 | 11 | 2 | 9 | 2.7 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(N(C)C)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL563259 | 196469 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 1 | 4 | ChEMBL | 520 | 11 | 2 | 9 | 2.7 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(N(C)C)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11685118 | 73026 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 2 | ChEMBL | 526 | 10 | 2 | 6 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(F)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201006 | 73026 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 2 | ChEMBL | 526 | 10 | 2 | 6 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(F)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451106 | 166381 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 4 | 2 | ChEMBL | 411 | 4 | 1 | 7 | 0.4 | CN1CCN(C(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL427602 | 166381 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | 4 | 2 | ChEMBL | 411 | 4 | 1 | 7 | 0.4 | CN1CCN(C(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 1892 | 204043 | None | 78 | Human | Binding | pKi | = | 4.8 | 4.8 | 34 | 3 | ChEMBL | 224 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCO)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL699 | 204043 | None | 78 | Human | Binding | pKi | = | 4.8 | 4.8 | 34 | 3 | ChEMBL | 224 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCO)n(C)c1=O | 10.1021/jm0104318 | |||
| 44452695 | 159560 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -52 | 3 | ChEMBL | 331 | 4 | 1 | 7 | 3.7 | c1coc(CNc2nc3ccccc3n3nc(-c4ccco4)nc23)c1 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL410264 | 159560 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -52 | 3 | ChEMBL | 331 | 4 | 1 | 7 | 3.7 | c1coc(CNc2nc3ccccc3n3nc(-c4ccco4)nc23)c1 | 10.1016/j.bmc.2007.10.103 | |||
| 10379032 | 7519 | None | 0 | Rat | Binding | pKi | = | 6.8 | 6.8 | -4 | 4 | ChEMBL | 282 | 3 | 1 | 5 | 1.3 | C=CCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL10873 | 7519 | None | 0 | Rat | Binding | pKi | = | 6.8 | 6.8 | -4 | 4 | ChEMBL | 282 | 3 | 1 | 5 | 1.3 | C=CCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(C)c1=O | 10.1021/jm0104318 | |||
| 72697789 | 104019 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -15 | 5 | ChEMBL | 355 | 3 | 0 | 8 | 1.0 | C#CCn1c(=O)c2c(nc3n2CCCN3Cc2cccs2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093315 | 104019 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -15 | 5 | ChEMBL | 355 | 3 | 0 | 8 | 1.0 | C#CCn1c(=O)c2c(nc3n2CCCN3Cc2cccs2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 136002187 | 108829 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 275 | 1 | 2 | 8 | -1.1 | Cn1nc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1N | 10.1021/jm0309654 | |||
| CHEMBL32098 | 108829 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 275 | 1 | 2 | 8 | -1.1 | Cn1nc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1N | 10.1021/jm0309654 | |||
| 156014066 | 177253 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2ccns2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4636018 | 177253 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2ccns2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 11133804 | 120023 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -13 | 4 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(nc(NC(=O)Nc3cccc(OC)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL350261 | 120023 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -13 | 4 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(nc(NC(=O)Nc3cccc(OC)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 3645619 | 3032 | None | 20 | Rat | Binding | pKi | = | 6.8 | 6.8 | -112 | 9 | ChEMBL | 334 | 4 | 1 | 4 | 2.4 | N#Cc1ccccc1N1CCN(CC1)CNC(=O)c1cccc(c1)C | 10.1021/jm970021c | |||
| 975 | 3032 | None | 20 | Rat | Binding | pKi | = | 6.8 | 6.8 | -112 | 9 | ChEMBL | 334 | 4 | 1 | 4 | 2.4 | N#Cc1ccccc1N1CCN(CC1)CNC(=O)c1cccc(c1)C | 10.1021/jm970021c | |||
| CHEMBL45244 | 3032 | None | 20 | Rat | Binding | pKi | = | 6.8 | 6.8 | -112 | 9 | ChEMBL | 334 | 4 | 1 | 4 | 2.4 | N#Cc1ccccc1N1CCN(CC1)CNC(=O)c1cccc(c1)C | 10.1021/jm970021c | |||
| CHEMBL5072422 | 214278 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -41 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(N)nc1-c1cccc(Cl)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 101420 | 162037 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | 1 | 3 | ChEMBL | 208 | 2 | 1 | 5 | -0.1 | CCn1c(=O)c2nc[nH]c2n(CC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL416013 | 162037 | None | 17 | Human | Binding | pKi | = | 5.8 | 5.8 | 1 | 3 | ChEMBL | 208 | 2 | 1 | 5 | -0.1 | CCn1c(=O)c2nc[nH]c2n(CC)c1=O | 10.1021/jm0104318 | |||
| 9836304 | 176913 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -7 | 4 | ChEMBL | 310 | 3 | 2 | 7 | 1.4 | Nc1nc(-c2cc[nH]n2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL461858 | 176913 | None | 0 | Human | Binding | pKi | = | 5.8 | 5.8 | -7 | 4 | ChEMBL | 310 | 3 | 2 | 7 | 1.4 | Nc1nc(-c2cc[nH]n2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 145993861 | 167396 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -1 | 4 | ChEMBL | 567 | 15 | 1 | 10 | 2.5 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN(CC)CC)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4295248 | 167396 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -1 | 4 | ChEMBL | 567 | 15 | 1 | 10 | 2.5 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN(CC)CC)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 135522367 | 110661 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 31 | 2 | ChEMBL | 493 | 8 | 2 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc5c(c4)OCO5)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32591 | 110661 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 31 | 2 | ChEMBL | 493 | 8 | 2 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc5c(c4)OCO5)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135522367 | 110661 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 31 | 2 | ChEMBL | 493 | 8 | 2 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc5c(c4)OCO5)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32591 | 110661 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 31 | 2 | ChEMBL | 493 | 8 | 2 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc5c(c4)OCO5)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11608581 | 72478 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 4 | 3 | ChEMBL | 258 | 3 | 1 | 8 | 0.5 | CCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1 | 10.1021/jm058018d | |||
| CHEMBL198942 | 72478 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 4 | 3 | ChEMBL | 258 | 3 | 1 | 8 | 0.5 | CCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1 | 10.1021/jm058018d | |||
| 10150517 | 94728 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 15 | 3 | ChEMBL | 382 | 6 | 2 | 6 | 2.3 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL253048 | 94728 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 15 | 3 | ChEMBL | 382 | 6 | 2 | 6 | 2.3 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 136042355 | 71146 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 12 | 2 | ChEMBL | 462 | 8 | 2 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955897 | 71146 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 12 | 2 | ChEMBL | 462 | 8 | 2 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44406642 | 72758 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 53 | 3 | ChEMBL | 485 | 8 | 1 | 11 | 2.5 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(C#N)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL199908 | 72758 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 53 | 3 | ChEMBL | 485 | 8 | 1 | 11 | 2.5 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(C#N)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 24827553 | 96024 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 24 | 4 | ChEMBL | 433 | 5 | 1 | 8 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccc(C(F)(F)F)nc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL259772 | 96024 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 24 | 4 | ChEMBL | 433 | 5 | 1 | 8 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccc(C(F)(F)F)nc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 53248698 | 60721 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 5 | 3 | ChEMBL | 534 | 6 | 1 | 6 | 4.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760886 | 60721 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 5 | 3 | ChEMBL | 534 | 6 | 1 | 6 | 4.8 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 53248699 | 63101 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 3 | 3 | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760897 | 63101 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 3 | 3 | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1789197 | 63101 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 3 | 3 | ChEMBL | 548 | 8 | 2 | 6 | 6.0 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)[C@H]3CC[C@H](NCc4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 49797749 | 10619 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 3 | 3 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cccn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170136 | 10619 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 3 | 3 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cccn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49798139 | 10670 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 5 | 3 | ChEMBL | 495 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCN(C)CC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170583 | 10670 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 5 | 3 | ChEMBL | 495 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCN(C)CC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 11575498 | 78317 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 3 | ChEMBL | 426 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(Cl)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210938 | 78317 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | 1 | 3 | ChEMBL | 426 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(Cl)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11582697 | 140156 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -2 | 3 | ChEMBL | 426 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(Cl)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL380284 | 140156 | None | 0 | Human | Binding | pKi | = | 7.8 | 7.8 | -2 | 3 | ChEMBL | 426 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(Cl)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 136042355 | 71146 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 12 | 2 | ChEMBL | 462 | 8 | 2 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955897 | 71146 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 12 | 2 | ChEMBL | 462 | 8 | 2 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 155561189 | 175659 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 4 | ChEMBL | 377 | 5 | 2 | 6 | 0.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N(C)C)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4581448 | 175659 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 4 | ChEMBL | 377 | 5 | 2 | 6 | 0.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N(C)C)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 11591558 | 73039 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 2 | ChEMBL | 508 | 9 | 2 | 6 | 5.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201054 | 73039 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 2 | ChEMBL | 508 | 9 | 2 | 6 | 5.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 128784 | 51801 | None | 45 | Human | Binding | pKi | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | 312 | 5 | 1 | 5 | 2.4 | CCCn1c(=O)c2nc(-c3ccccc3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL158507 | 51801 | None | 45 | Human | Binding | pKi | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | 312 | 5 | 1 | 5 | 2.4 | CCCn1c(=O)c2nc(-c3ccccc3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 128784 | 51801 | None | 45 | Human | Binding | pKi | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | 312 | 5 | 1 | 5 | 2.4 | CCCn1c(=O)c2nc(-c3ccccc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| CHEMBL158507 | 51801 | None | 45 | Human | Binding | pKi | = | 7.7 | 7.7 | -2 | 5 | ChEMBL | 312 | 5 | 1 | 5 | 2.4 | CCCn1c(=O)c2nc(-c3ccccc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| 11102838 | 169032 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 3 | ChEMBL | 475 | 7 | 1 | 9 | 4.4 | CSc1c2c(nc(NC(=O)Cc3ccc(CC(C)C)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL439447 | 169032 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -3 | 3 | ChEMBL | 475 | 7 | 1 | 9 | 4.4 | CSc1c2c(nc(NC(=O)Cc3ccc(CC(C)C)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 11133545 | 120468 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -13 | 4 | ChEMBL | 419 | 4 | 2 | 10 | 2.8 | Cn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL354161 | 120468 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -13 | 4 | ChEMBL | 419 | 4 | 2 | 10 | 2.8 | Cn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL5081556 | 214751 | None | 0 | Human | Binding | pKi | = | 6.8 | 6.8 | -5 | 5 | ChEMBL | None | None | None | Nc1nc(-c2ccccc2)c2c(n1)-c1ccc(OCCCN3CCCC3)cc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||||
| 4882 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/acs.jmedchem.0c00237 | |||
| 5311037 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/acs.jmedchem.0c00237 | |||
| 5608 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL431770 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/acs.jmedchem.0c00237 | |||
| DB11757 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/acs.jmedchem.0c00237 | |||
| 4882 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/jm4011669 | |||
| 5311037 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/jm4011669 | |||
| 5608 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/jm4011669 | |||
| CHEMBL431770 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/jm4011669 | |||
| DB11757 | 2097 | None | 82 | Human | Binding | pKi | = | 5.8 | 5.8 | -104 | 6 | ChEMBL | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 10.1021/jm4011669 | |||
| 11144868 | 119870 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -12 | 4 | ChEMBL | 452 | 3 | 2 | 8 | 3.7 | Cn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL348925 | 119870 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -12 | 4 | ChEMBL | 452 | 3 | 2 | 8 | 3.7 | Cn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 21874681 | 189096 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -114 | 4 | ChEMBL | 321 | 4 | 2 | 8 | 2.2 | CNc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| CHEMBL510134 | 189096 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -114 | 4 | ChEMBL | 321 | 4 | 2 | 8 | 2.2 | CNc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| 2882039 | 28236 | None | 11 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 294 | 3 | 1 | 4 | 2.7 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1C | 10.1021/ml400185v | |||
| CHEMBL1373953 | 28236 | None | 11 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 294 | 3 | 1 | 4 | 2.7 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1C | 10.1021/ml400185v | |||
| 12267225 | 141627 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -3 | 3 | ChEMBL | 255 | 1 | 1 | 4 | 1.2 | Cn1c(=O)c2[nH]c(-c3ccccc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL38528 | 141627 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -3 | 3 | ChEMBL | 255 | 1 | 1 | 4 | 1.2 | Cn1c(=O)c2[nH]c(-c3ccccc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 44390549 | 63485 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5Cl)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL179932 | 63485 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5Cl)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 45268869 | 195549 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -48 | 4 | ChEMBL | 328 | 4 | 2 | 5 | 2.9 | Nc1nc(C(=O)NCc2cccc(Cl)c2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL554623 | 195549 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -48 | 4 | ChEMBL | 328 | 4 | 2 | 5 | 2.9 | Nc1nc(C(=O)NCc2cccc(Cl)c2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 44520985 | 199856 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -338 | 4 | ChEMBL | 340 | 5 | 2 | 7 | 2.3 | Cc1ccc(-c2cc(C(=O)NCc3nccn3C(C)C)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| CHEMBL594455 | 199856 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -338 | 4 | ChEMBL | 340 | 5 | 2 | 7 | 2.3 | Cc1ccc(-c2cc(C(=O)NCc3nccn3C(C)C)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| 135440428 | 78538 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL2112066 | 78538 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 483 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL5081937 | 214776 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -3 | 2 | ChEMBL | None | None | None | COc1ccc(-c2nc(Nc3ccccc3)nc(-c3ccccc3)c2C#N)cc1 | 10.1021/acs.jmedchem.1c01636 | |||||
| CHEMBL5088089 | 215135 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -13 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(N)nc1-c1cccc(F)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 1329 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| 386 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| CHEMBL183 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| DB12946 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| 44406906 | 72808 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 447 | 7 | 3 | 7 | 1.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CCN)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL200105 | 72808 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 447 | 7 | 3 | 7 | 1.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CCN)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11547533 | 140911 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 482 | 7 | 2 | 7 | 2.6 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)NCc1ccc(Cl)cc1 | 10.1021/jm0506221 | |||
| CHEMBL382234 | 140911 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 2 | ChEMBL | 482 | 7 | 2 | 7 | 2.6 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)NCc1ccc(Cl)cc1 | 10.1021/jm0506221 | |||
| 10605011 | 118758 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -4 | 4 | ChEMBL | 732 | 6 | 2 | 8 | 7.6 | O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCc3cc(Br)c(Br)cc3Br)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL341852 | 118758 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -4 | 4 | ChEMBL | 732 | 6 | 2 | 8 | 7.6 | O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCc3cc(Br)c(Br)cc3Br)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 76320909 | 104031 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 6 | ChEMBL | 300 | 1 | 1 | 5 | 1.0 | Cn1c(=O)c2[nH]c([C@]34C[C@@H]5C[C@H](C[C@H]3C5)C4)nc2n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093327 | 104031 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 6 | ChEMBL | 300 | 1 | 1 | 5 | 1.0 | Cn1c(=O)c2[nH]c([C@]34C[C@@H]5C[C@H](C[C@H]3C5)C4)nc2n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 15667105 | 108742 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -263 | 5 | ChEMBL | 384 | 7 | 1 | 5 | 3.6 | CCCCn1c(=O)c2nc(C34CC5CC(CC3C5)C4)[nH]c2n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL320872 | 108742 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -263 | 5 | ChEMBL | 384 | 7 | 1 | 5 | 3.6 | CCCCn1c(=O)c2nc(C34CC5CC(CC3C5)C4)[nH]c2n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 11689583 | 3212 | None | 29 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 7 | ChEMBL | 386 | 7 | 2 | 6 | 2.1 | OCCCn1c2[nH]c(nc2c(=O)n(c1=O)CCCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| 3285 | 3212 | None | 29 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 7 | ChEMBL | 386 | 7 | 2 | 6 | 2.1 | OCCCn1c2[nH]c(nc2c(=O)n(c1=O)CCCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL1316674 | 3212 | None | 29 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 7 | ChEMBL | 386 | 7 | 2 | 6 | 2.1 | OCCCn1c2[nH]c(nc2c(=O)n(c1=O)CCCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| 11780616 | 203609 | None | 5 | Rat | Binding | pKi | = | 4.7 | 4.7 | -1 | 4 | ChEMBL | 270 | 4 | 0 | 6 | 0.5 | Cn1c(=O)c2c(ncn2CCCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL67060 | 203609 | None | 5 | Rat | Binding | pKi | = | 4.7 | 4.7 | -1 | 4 | ChEMBL | 270 | 4 | 0 | 6 | 0.5 | Cn1c(=O)c2c(ncn2CCCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 136044130 | 49110 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 3 | ChEMBL | 402 | 8 | 3 | 8 | 1.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)O)cc3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL156178 | 49110 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 3 | ChEMBL | 402 | 8 | 3 | 8 | 1.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)O)cc3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL5090384 | 215257 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -16 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(Nc2ccccc2)nc1-c1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.1c01636 | |||||
| 128525 | 154722 | None | 10 | Rat | Binding | pKi | = | 5.7 | 5.7 | -5 | 6 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| CHEMBL39986 | 154722 | None | 10 | Rat | Binding | pKi | = | 5.7 | 5.7 | -5 | 6 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| 44401051 | 124369 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -23442 | 4 | ChEMBL | 355 | 3 | 4 | 9 | 0.4 | O[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm049408n | |||
| CHEMBL363807 | 124369 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -23442 | 4 | ChEMBL | 355 | 3 | 4 | 9 | 0.4 | O[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm049408n | |||
| 11395785 | 186512 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -15488 | 4 | ChEMBL | 410 | 5 | 4 | 9 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.7b00457 | |||
| CHEMBL487754 | 186512 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -15488 | 4 | ChEMBL | 410 | 5 | 4 | 9 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/acs.jmedchem.7b00457 | |||
| 22282339 | 83102 | None | 3 | Mouse | Binding | pKi | = | 6.7 | 6.7 | -275 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| CHEMBL2181976 | 83102 | None | 3 | Mouse | Binding | pKi | = | 6.7 | 6.7 | -275 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| CHEMBL5084951 | 83102 | None | 3 | Mouse | Binding | pKi | = | 6.7 | 6.7 | -275 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/acs.jmedchem.7b00457 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/ml200189u | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/ml200189u | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/ml200189u | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/ml200189u | |||
| 162660983 | 181869 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 294 | 2 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)(C)C)C(c2ccoc2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4778860 | 181869 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 294 | 2 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)(C)C)C(c2ccoc2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 135546649 | 116634 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33695 | 116634 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135546649 | 116634 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33695 | 116634 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 66894703 | 157591 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 511 | 8 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5F)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4080807 | 157591 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 511 | 8 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5F)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44588438 | 189117 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 8 | 2 | ChEMBL | 342 | 5 | 3 | 6 | 2.3 | CCCn1c(=O)c2[nH]c(-c3ccc(N)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL510409 | 189117 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 8 | 2 | ChEMBL | 342 | 5 | 3 | 6 | 2.3 | CCCn1c(=O)c2[nH]c(-c3ccc(N)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 136042333 | 71158 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 10 | 2 | ChEMBL | 514 | 8 | 2 | 9 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955909 | 71158 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 10 | 2 | ChEMBL | 514 | 8 | 2 | 9 | 3.4 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44406545 | 72889 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 25 | 4 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5Cl)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200370 | 72889 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 25 | 4 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5Cl)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 21958557 | 95787 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 364 | 5 | 1 | 7 | 1.7 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL258686 | 95787 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 364 | 5 | 1 | 7 | 1.7 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 49797795 | 10614 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 3 | ChEMBL | 447 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170129 | 10614 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 3 | ChEMBL | 447 | 6 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797904 | 10740 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 2 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(C)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171163 | 10740 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 2 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(C)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 52948949 | 19268 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 2 | ChEMBL | 494 | 8 | 3 | 4 | 5.4 | O=C(NCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290322 | 19268 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 2 | ChEMBL | 494 | 8 | 3 | 4 | 5.4 | O=C(NCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11588630 | 78105 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 364 | 5 | 1 | 7 | 1.8 | CCn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(CC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210271 | 78105 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 364 | 5 | 1 | 7 | 1.8 | CCn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(CC)c1=O | 10.1021/jm051268+ | |||
| 640847 | 100057 | None | 1 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 4 | ChEMBL | 256 | 2 | 2 | 4 | 1.1 | CCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL287129 | 100057 | None | 1 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 4 | ChEMBL | 256 | 2 | 2 | 4 | 1.1 | CCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm011049y | |||
| 11591029 | 141294 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 2 | ChEMBL | 476 | 9 | 3 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL383321 | 141294 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 2 | ChEMBL | 476 | 9 | 3 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 46228022 | 199907 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 368 | 6 | 0 | 8 | 2.1 | CCCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594734 | 199907 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 368 | 6 | 0 | 8 | 2.1 | CCCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.7 | 7.7 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.bmc.2010.02.014 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.7 | 7.7 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.bmc.2010.02.014 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.7 | 7.7 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.bmc.2010.02.014 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.7 | 7.7 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.bmc.2010.02.014 | |||
| 11570614 | 140683 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 8 | 2 | ChEMBL | 586 | 9 | 2 | 6 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL381522 | 140683 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 8 | 2 | ChEMBL | 586 | 9 | 2 | 6 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44185935 | 185531 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | ChEMBL | 417 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486281 | 185531 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | ChEMBL | 417 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 11627494 | 72319 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 502 | 10 | 2 | 7 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL198403 | 72319 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 502 | 10 | 2 | 7 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11517907 | 74695 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 444 | 5 | 3 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4nc5ccccc5[nH]4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203043 | 74695 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 444 | 5 | 3 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4nc5ccccc5[nH]4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44236603 | 157387 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 446 | 6 | 2 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4078316 | 157387 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 446 | 6 | 2 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 1509337 | 49128 | None | 13 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 3 | ChEMBL | 324 | 5 | 1 | 7 | 2.2 | COc1cccc(COC(=O)c2nn(-c3ccccc3)nc2N)c1 | 10.1021/acs.jmedchem.8b00204 | |||
| CHEMBL1561896 | 49128 | None | 13 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 3 | ChEMBL | 324 | 5 | 1 | 7 | 2.2 | COc1cccc(COC(=O)c2nn(-c3ccccc3)nc2N)c1 | 10.1021/acs.jmedchem.8b00204 | |||
| 46233161 | 200521 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -2 | 4 | ChEMBL | 358 | 7 | 1 | 6 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(CCSCC)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL598819 | 200521 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -2 | 4 | ChEMBL | 358 | 7 | 1 | 6 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(CCSCC)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1039/d2md00132b | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1039/d2md00132b | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1039/d2md00132b | |||
| 135404340 | 82395 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -229 | 3 | ChEMBL | 427 | 7 | 2 | 4 | 4.1 | CCCN1C(=O)N2C[C@@H](CC)N=C2c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| CHEMBL217268 | 82395 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -229 | 3 | ChEMBL | 427 | 7 | 2 | 4 | 4.1 | CCCN1C(=O)N2C[C@@H](CC)N=C2c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| 11408692 | 75558 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -2511 | 4 | ChEMBL | 466 | 6 | 5 | 10 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL204527 | 75558 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -2511 | 4 | ChEMBL | 466 | 6 | 5 | 10 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 3467695 | 90942 | None | 41 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 328 | 4 | 2 | 4 | 3.1 | CC1=C(C(=O)OCc2ccccc2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL239336 | 90942 | None | 41 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 328 | 4 | 2 | 4 | 3.1 | CC1=C(C(=O)OCc2ccccc2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 21874668 | 176888 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -21 | 4 | ChEMBL | 282 | 3 | 1 | 8 | 1.7 | Nc1nc(-c2ccco2)c2nnn(Cc3ccco3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL461650 | 176888 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -21 | 4 | ChEMBL | 282 | 3 | 1 | 8 | 1.7 | Nc1nc(-c2ccco2)c2nnn(Cc3ccco3)c2n1 | 10.1021/jm800961g | |||
| 145986422 | 167144 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 4 | ChEMBL | 565 | 13 | 1 | 10 | 2.2 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4290710 | 167144 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 4 | ChEMBL | 565 | 13 | 1 | 10 | 2.2 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 76313652 | 103844 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091701 | 103844 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 76313652 | 103844 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=S)N1 | 10.1021/ml400185v | |||
| CHEMBL3091701 | 103844 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)NC(=S)N1 | 10.1021/ml400185v | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1039/d2md00132b | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1039/d2md00132b | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 6.7 | 6.7 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1039/d2md00132b | |||
| 3286 | 3207 | None | 31 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -16 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| 5311479 | 3207 | None | 31 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -16 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL8565 | 3207 | None | 31 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -16 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| 95028 | 93806 | None | 31 | Human | Binding | pKi | = | 4.7 | 4.7 | -3 | 4 | ChEMBL | 270 | 2 | 0 | 6 | 0.5 | Cn1c(=O)c2c(ncn2Cc2ccccc2)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL24759 | 93806 | None | 31 | Human | Binding | pKi | = | 4.7 | 4.7 | -3 | 4 | ChEMBL | 270 | 2 | 0 | 6 | 0.5 | Cn1c(=O)c2c(ncn2Cc2ccccc2)n(C)c1=O | 10.1021/jm0104318 | |||
| 44406334 | 72930 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 16 | 3 | ChEMBL | 489 | 9 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccccc5OC)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200509 | 72930 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 16 | 3 | ChEMBL | 489 | 9 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccccc5OC)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11112543 | 57151 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccccc3OC)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164647 | 57151 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccccc3OC)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 2748296 | 182152 | None | 8 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 278 | 4 | 2 | 4 | 2.1 | CC1=C(C(=O)OCC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4782393 | 182152 | None | 8 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 278 | 4 | 2 | 4 | 2.1 | CC1=C(C(=O)OCC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 11267343 | 175348 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 3 | 2 | ChEMBL | 325 | 5 | 1 | 4 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(C)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457442 | 175348 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 3 | 2 | ChEMBL | 325 | 5 | 1 | 4 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(C)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 21916371 | 95881 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 3 | 3 | ChEMBL | 446 | 5 | 1 | 7 | 3.0 | CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL259129 | 95881 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 3 | 3 | ChEMBL | 446 | 5 | 1 | 7 | 3.0 | CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 9902562 | 172633 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -23 | 4 | ChEMBL | 341 | 3 | 1 | 8 | 2.4 | Cc1cnc(-c2nc(N)nc3c2nnn3Cc2ccccc2F)s1 | 10.1021/jm800961g | |||
| CHEMBL449469 | 172633 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -23 | 4 | ChEMBL | 341 | 3 | 1 | 8 | 2.4 | Cc1cnc(-c2nc(N)nc3c2nnn3Cc2ccccc2F)s1 | 10.1021/jm800961g | |||
| 11649548 | 72779 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 539 | 10 | 3 | 8 | 2.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(S(N)(=O)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL200011 | 72779 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 539 | 10 | 3 | 8 | 2.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(S(N)(=O)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 46227958 | 200112 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 3 | ChEMBL | 432 | 7 | 1 | 7 | 2.8 | CSCCn1c(=O)c2[nH]c(Cc3c(F)cccc3F)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL596125 | 200112 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 3 | ChEMBL | 432 | 7 | 1 | 7 | 2.8 | CSCCn1c(=O)c2[nH]c(Cc3c(F)cccc3F)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 45268854 | 196065 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 392 | 10 | 1 | 8 | 1.9 | CCSCCn1c(=O)c2[nH]c(Cc3ccco3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL560562 | 196065 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 392 | 10 | 1 | 8 | 1.9 | CCSCCn1c(=O)c2[nH]c(Cc3ccco3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 19574107 | 75439 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -50 | 2 | ChEMBL | 300 | 3 | 2 | 4 | 3.0 | COc1cccc2cc(C(=O)NC3CCCCC3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042059 | 75439 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -50 | 2 | ChEMBL | 300 | 3 | 2 | 4 | 3.0 | COc1cccc2cc(C(=O)NC3CCCCC3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.bmcl.2004.11.044 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.bmcl.2004.11.044 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.bmcl.2004.11.044 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm201292w | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm201292w | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm201292w | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm201292w | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2016.11.007 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2016.11.007 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2016.11.007 | |||
| 44451329 | 96181 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 204 | 2 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cc1ccc(N2CCN(C(=O)C(C)Oc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260692 | 96181 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 204 | 2 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cc1ccc(N2CCN(C(=O)C(C)Oc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| 44451127 | 161278 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 44 | 4 | ChEMBL | 569 | 7 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL412112 | 161278 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 44 | 4 | ChEMBL | 569 | 7 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 46880475 | 5533 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 7 | 4 | ChEMBL | 333 | 4 | 1 | 3 | 4.3 | O=C(Nc1ccc(-c2ccncc2)c(-c2cccc(F)c2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1076587 | 5533 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 7 | 4 | ChEMBL | 333 | 4 | 1 | 3 | 4.3 | O=C(Nc1ccc(-c2ccncc2)c(-c2cccc(F)c2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46880474 | 6345 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 30 | 4 | ChEMBL | 333 | 4 | 1 | 3 | 4.3 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccccc2F)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082028 | 6345 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 30 | 4 | ChEMBL | 333 | 4 | 1 | 3 | 4.3 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccccc2F)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 53318745 | 58029 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 325 | 4 | 1 | 6 | 2.7 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cnco2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672633 | 58029 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 325 | 4 | 1 | 6 | 2.7 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cnco2)n1)C1CC1 | 10.1021/ml100249e | |||
| 44574222 | 189306 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -5 | 4 | ChEMBL | 478 | 8 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL512276 | 189306 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -5 | 4 | ChEMBL | 478 | 8 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 22266746 | 157762 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 36 | 4 | ChEMBL | 350 | 4 | 1 | 7 | 1.4 | CCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL408266 | 157762 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 36 | 4 | ChEMBL | 350 | 4 | 1 | 7 | 1.4 | CCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm051268+ | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm051268+ | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm051268+ | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm051268+ | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2018.11.045 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2018.11.045 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1016/j.ejmech.2018.11.045 | |||
| 44451127 | 161278 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 44 | 4 | ChEMBL | 569 | 7 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL412112 | 161278 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 44 | 4 | ChEMBL | 569 | 7 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 44574192 | 178808 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 20 | 2 | ChEMBL | 444 | 3 | 1 | 6 | 2.9 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCc5ccccc5C4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL469136 | 178808 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 20 | 2 | ChEMBL | 444 | 3 | 1 | 6 | 2.9 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCc5ccccc5C4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 11801496 | 98744 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 7 | 6 | ChEMBL | 587 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL278039 | 98744 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 7 | 6 | ChEMBL | 587 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 168297247 | 192375 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(N=C=S)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5207498 | 192375 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(N=C=S)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 11649544 | 73131 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 9 | 4 | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201145 | 73131 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 9 | 4 | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 57429615 | 159750 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 442 | 4 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4105001 | 159750 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | - | 1 | ChEMBL | 442 | 4 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 16072021 | 58007 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 19 | 4 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672611 | 58007 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 19 | 4 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CC1 | 10.1021/ml100249e | |||
| 16071777 | 58015 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 4 | ChEMBL | 320 | 4 | 1 | 5 | 3.5 | Cc1ccc(-c2nc(NC(=O)C3CC3)cnc2-c2ccncc2)o1 | 10.1021/ml100249e | |||
| CHEMBL1672619 | 58015 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | -1 | 4 | ChEMBL | 320 | 4 | 1 | 5 | 3.5 | Cc1ccc(-c2nc(NC(=O)C3CC3)cnc2-c2ccncc2)o1 | 10.1021/ml100249e | |||
| 11649544 | 73131 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 9 | 4 | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL201145 | 73131 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 9 | 4 | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 10767043 | 59021 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 7 | 6 | ChEMBL | 479 | 9 | 2 | 7 | 3.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL16929 | 59021 | None | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 7 | 6 | ChEMBL | 479 | 9 | 2 | 7 | 3.5 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 9827315 | 95844 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 40 | 2 | ChEMBL | 500 | 8 | 1 | 6 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258978 | 95844 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 40 | 2 | ChEMBL | 500 | 8 | 1 | 6 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 46837704 | 10621 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 32 | 3 | ChEMBL | 436 | 7 | 3 | 5 | 3.3 | CCCn1c(=O)[nH]c2cc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1170166 | 10621 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 32 | 3 | ChEMBL | 436 | 7 | 3 | 5 | 3.3 | CCCn1c(=O)[nH]c2cc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| 10840167 | 59176 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 3 | 6 | ChEMBL | 539 | 9 | 2 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL17003 | 59176 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 3 | 6 | ChEMBL | 539 | 9 | 2 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 168271107 | 190067 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5172513 | 190067 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 44450997 | 96033 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 398 | 2 | ChEMBL | 500 | 7 | 1 | 6 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259857 | 96033 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 398 | 2 | ChEMBL | 500 | 7 | 1 | 6 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 11123022 | 132123 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -1 | 3 | ChEMBL | 438 | 5 | 1 | 5 | 3.0 | CCCn1c(=O)c2nc(-c3ccc(I)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| CHEMBL36963 | 132123 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -1 | 3 | ChEMBL | 438 | 5 | 1 | 5 | 3.0 | CCCn1c(=O)c2nc(-c3ccc(I)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| 44450997 | 96033 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 398 | 2 | ChEMBL | 500 | 7 | 1 | 6 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259857 | 96033 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 398 | 2 | ChEMBL | 500 | 7 | 1 | 6 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 76321753 | 105512 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -10 | 4 | ChEMBL | 371 | 7 | 1 | 7 | 1.3 | CCN(CC)CCOc1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121721 | 105512 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -10 | 4 | ChEMBL | 371 | 7 | 1 | 7 | 1.3 | CCN(CC)CCOc1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.ejmech.2014.01.045 | |||
| 57429644 | 159344 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 557 | 9 | 1 | 8 | 4.0 | CCCn1c(=O)c2[nH]c(-c3cnn(CCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4100199 | 159344 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 557 | 9 | 1 | 8 | 4.0 | CCCn1c(=O)c2[nH]c(-c3cnn(CCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44587957 | 188812 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 35 | 4 | ChEMBL | 559 | 10 | 2 | 8 | 3.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL506179 | 188812 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 35 | 4 | ChEMBL | 559 | 10 | 2 | 8 | 3.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11684443 | 133157 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 4 | 4 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL370378 | 133157 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 4 | 4 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11684443 | 133157 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 4 | 4 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL370378 | 133157 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 4 | 4 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11111247 | 119729 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 4 | 3 | ChEMBL | 362 | 4 | 2 | 4 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL34762 | 119729 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 4 | 3 | ChEMBL | 362 | 4 | 2 | 4 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 72197880 | 90796 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -4 | 4 | ChEMBL | 347 | 4 | 1 | 5 | 4.7 | O=C(Nc1nc(-c2ccccc2)c(-c2ccncc2)s1)c1ccco1 | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL2391834 | 90796 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -4 | 4 | ChEMBL | 347 | 4 | 1 | 5 | 4.7 | O=C(Nc1nc(-c2ccccc2)c(-c2ccncc2)s1)c1ccco1 | 10.1016/j.ejmech.2019.111879 | |||
| 57429616 | 157680 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 458 | 5 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4081707 | 157680 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 458 | 5 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44574117 | 189309 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -1 | 4 | ChEMBL | 404 | 4 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL512290 | 189309 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | -1 | 4 | ChEMBL | 404 | 4 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 44451330 | 96182 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 53 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260693 | 96182 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 53 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 168297723 | 192450 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3cccc(N=C=S)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5208506 | 192450 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | - | 1 | ChEMBL | 327 | 4 | 2 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3cccc(N=C=S)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 44219683 | 196494 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 33 | 4 | ChEMBL | 555 | 10 | 2 | 8 | 3.4 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL563425 | 196494 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 33 | 4 | ChEMBL | 555 | 10 | 2 | 8 | 3.4 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 44450981 | 95937 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 112 | 2 | ChEMBL | 522 | 5 | 2 | 7 | 2.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(O)(c5ccc(Cl)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259360 | 95937 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 112 | 2 | ChEMBL | 522 | 5 | 2 | 7 | 2.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(O)(c5ccc(Cl)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 76318040 | 105513 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | -10 | 4 | ChEMBL | 383 | 5 | 2 | 7 | 1.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCCC4CCNCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121722 | 105513 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | -10 | 4 | ChEMBL | 383 | 5 | 2 | 7 | 1.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCCC4CCNCC4)cc3)nc2n(C)c1=O | 10.1016/j.ejmech.2014.01.045 | |||
| 10962751 | 162634 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 5 | 3 | ChEMBL | 560 | 9 | 2 | 8 | 2.7 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)OCc5ccccc5)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL416963 | 162634 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 5 | 3 | ChEMBL | 560 | 9 | 2 | 8 | 2.7 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)OCc5ccccc5)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 135522388 | 100110 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL287529 | 100110 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135522388 | 100110 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL287529 | 100110 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10007115 | 116342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 5 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2010.09.043 | |||
| CHEMBL335950 | 116342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 5 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1016/j.bmc.2010.09.043 | |||
| 10007115 | 116342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 5 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL335950 | 116342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 5 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/acs.jmedchem.5b01586 | |||
| 10007115 | 116342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 5 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL335950 | 116342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 5 | ChEMBL | 527 | 8 | 1 | 8 | 5.7 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 155530961 | 171589 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 4 | ChEMBL | 513 | 7 | 1 | 8 | 5.8 | O=C(Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12)c1cccc2ccccc12 | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4465141 | 171589 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 4 | ChEMBL | 513 | 7 | 1 | 8 | 5.8 | O=C(Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12)c1cccc2ccccc12 | 10.1021/acs.jmedchem.9b00071 | |||
| 136042327 | 71144 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 512 | 8 | 2 | 9 | 3.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc6ccccc6cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955893 | 71144 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 512 | 8 | 2 | 9 | 3.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc6ccccc6cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135874424 | 95846 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 469 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3ccn(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258987 | 95846 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 469 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3ccn(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 24827554 | 95982 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 17 | 4 | ChEMBL | 447 | 5 | 1 | 8 | 2.8 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cnn(-c4ccc(C(F)(F)F)nc4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL259565 | 95982 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 17 | 4 | ChEMBL | 447 | 5 | 1 | 8 | 2.8 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cnn(-c4ccc(C(F)(F)F)nc4)c3)nc21 | 10.1021/jm7014815 | |||
| 52950040 | 19158 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 523 | 10 | 2 | 5 | 6.1 | CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289569 | 19158 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 523 | 10 | 2 | 5 | 6.1 | CC[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11547107 | 77078 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(C(F)(F)F)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL207434 | 77078 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(C(F)(F)F)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11495611 | 139082 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 426 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL378652 | 139082 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 426 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11503942 | 73089 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 480 | 8 | 2 | 6 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(Cl)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201109 | 73089 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 480 | 8 | 2 | 6 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(Cl)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451230 | 96384 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 573 | 9 | 1 | 8 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)Oc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL261792 | 96384 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 2 | ChEMBL | 573 | 9 | 1 | 8 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)Oc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44451492 | 159073 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 17 | 2 | ChEMBL | 487 | 5 | 1 | 7 | 2.3 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)N1CCN(c2ccccc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL409726 | 159073 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 17 | 2 | ChEMBL | 487 | 5 | 1 | 7 | 2.3 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)N1CCN(c2ccccc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 50940978 | 57277 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -3 | 4 | ChEMBL | 283 | 4 | 1 | 5 | 3.3 | CCC(=O)Nc1cc(-c2ccco2)nc(-c2ccco2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650385 | 57277 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -3 | 4 | ChEMBL | 283 | 4 | 1 | 5 | 3.3 | CCC(=O)Nc1cc(-c2ccco2)nc(-c2ccco2)n1 | 10.1021/jm100843z | |||
| 127033039 | 138999 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3785582 | 138999 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.0c00564 | |||
| 127033039 | 138999 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785582 | 138999 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.5b01586 | |||
| 127033039 | 138999 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3785582 | 138999 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 323 | 3 | 1 | 6 | 3.5 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 136044106 | 49947 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 344 | 5 | 3 | 7 | 1.8 | CCCn1c(=O)c2nc(-c3ccc(O)cc3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL156863 | 49947 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 344 | 5 | 3 | 7 | 1.8 | CCCn1c(=O)c2nc(-c3ccc(O)cc3O)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 45267991 | 196103 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | ChEMBL | 468 | 10 | 2 | 10 | 1.6 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccon4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL560905 | 196103 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | ChEMBL | 468 | 10 | 2 | 10 | 1.6 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccon4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11525816 | 73358 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 2 | ChEMBL | 477 | 9 | 3 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ncccc4O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201329 | 73358 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 15 | 2 | ChEMBL | 477 | 9 | 3 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ncccc4O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44450904 | 96096 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 28 | 2 | ChEMBL | 528 | 9 | 1 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260180 | 96096 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 28 | 2 | ChEMBL | 528 | 9 | 1 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 9887859 | 113510 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL118923 | 113510 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL332091 | 113510 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.bmc.2011.11.037 | |||
| 137636200 | 156064 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 425 | 9 | 1 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN(CC)CC)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4062691 | 156064 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 425 | 9 | 1 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN(CC)CC)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 9887859 | 113510 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| CHEMBL118923 | 113510 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| CHEMBL332091 | 113510 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| 11569515 | 78213 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 494 | 7 | 1 | 7 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(Cl)c(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210565 | 78213 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 494 | 7 | 1 | 7 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(Cl)c(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 135428630 | 81581 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -2818 | 5 | ChEMBL | 385 | 4 | 2 | 4 | 3.2 | CCCN1C(=O)N2C[C@@H](C(C)C)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| CHEMBL216269 | 81581 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -2818 | 5 | ChEMBL | 385 | 4 | 2 | 4 | 3.2 | CCCN1C(=O)N2C[C@@H](C(C)C)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| 162663149 | 181947 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 278 | 4 | 2 | 4 | 2.2 | CCC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4779925 | 181947 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 278 | 4 | 2 | 4 | 2.2 | CCC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 162667688 | 182477 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 280 | 4 | 2 | 4 | 2.3 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4786646 | 182477 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 280 | 4 | 2 | 4 | 2.3 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 46880472 | 6076 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 305 | 4 | 2 | 4 | 2.9 | O=C(Nc1ccc(-c2ccncc2)c(-c2cc[nH]n2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1080678 | 6076 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 305 | 4 | 2 | 4 | 2.9 | O=C(Nc1ccc(-c2ccncc2)c(-c2cc[nH]n2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 10765059 | 102693 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -354 | 4 | ChEMBL | 430 | 6 | 2 | 9 | 3.6 | C=CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL304726 | 102693 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -354 | 4 | ChEMBL | 430 | 6 | 2 | 9 | 3.6 | C=CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 123683 | 3119 | None | 63 | Human | Binding | pKi | = | 5.7 | 5.7 | -95499 | 13 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.bmcl.2006.01.110 | |||
| 422 | 3119 | None | 63 | Human | Binding | pKi | = | 5.7 | 5.7 | -95499 | 13 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL119709 | 3119 | None | 63 | Human | Binding | pKi | = | 5.7 | 5.7 | -95499 | 13 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.bmcl.2006.01.110 | |||
| DB05511 | 3119 | None | 63 | Human | Binding | pKi | = | 5.7 | 5.7 | -95499 | 13 | ChEMBL | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10.1016/j.bmcl.2006.01.110 | |||
| 123807 | 870 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm9905965 | |||
| 374 | 870 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm9905965 | |||
| 379 | 870 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm9905965 | |||
| CHEMBL284969 | 870 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -13803 | 13 | ChEMBL | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm9905965 | |||
| 9822747 | 119379 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -16 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL344501 | 119379 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -16 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 9822747 | 119379 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -16 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL344501 | 119379 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -16 | 4 | ChEMBL | 408 | 3 | 2 | 8 | 3.6 | Cn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2011.05.023 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2011.05.023 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2011.05.023 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2011.05.023 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2011.05.023 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.0c00237 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.0c00237 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.0c00237 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.0c00237 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm4011669 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm4011669 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm4011669 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm4011669 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm4011669 | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm001047y | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm001047y | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm001047y | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm001047y | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010818a | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010818a | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010818a | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010818a | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm0109614 | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm0109614 | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm0109614 | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm0109614 | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010570p | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010570p | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010570p | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1021/jm010570p | |||
| 15524546 | 103849 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091707 | 103849 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 21874662 | 189367 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -23 | 4 | ChEMBL | 332 | 3 | 2 | 8 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]ncc4c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL512812 | 189367 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -23 | 4 | ChEMBL | 332 | 3 | 2 | 8 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]ncc4c3)c2n1 | 10.1021/jm800961g | |||
| 15524546 | 103849 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL3091707 | 103849 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| 135486084 | 13849 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -3 | 2 | ChEMBL | 416 | 9 | 3 | 9 | 0.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)CCCN)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL1195913 | 13849 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -3 | 2 | ChEMBL | 416 | 9 | 3 | 9 | 0.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)CCCN)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL555577 | 13849 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -3 | 2 | ChEMBL | 416 | 9 | 3 | 9 | 0.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)CCCN)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 44390651 | 64768 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 511 | 9 | 1 | 10 | 3.9 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(C#N)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181925 | 64768 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 1 | 2 | ChEMBL | 511 | 9 | 1 | 10 | 3.9 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(C#N)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 135546658 | 116290 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -2 | 2 | ChEMBL | 511 | 9 | 2 | 9 | 2.8 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)n(C)n3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33591 | 116290 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -2 | 2 | ChEMBL | 511 | 9 | 2 | 9 | 2.8 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)n(C)n3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| 11995557 | 165857 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -26 | 4 | ChEMBL | 459 | 8 | 2 | 8 | 1.6 | CCCn1c(=O)c2nc([C@]34CC[C@](C(=O)NCC(=O)OC)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL424908 | 165857 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -26 | 4 | ChEMBL | 459 | 8 | 2 | 8 | 1.6 | CCCn1c(=O)c2nc([C@]34CC[C@](C(=O)NCC(=O)OC)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 46880511 | 6156 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccncn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081042 | 6156 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccncn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 44390587 | 63912 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(Cl)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL180588 | 63912 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(Cl)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 350741 | 163415 | None | 2 | Human | Binding | pKi | = | 4.7 | 4.7 | - | 1 | ChEMBL | 236 | 2 | 0 | 7 | -1.0 | CC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL419617 | 163415 | None | 2 | Human | Binding | pKi | = | 4.7 | 4.7 | - | 1 | ChEMBL | 236 | 2 | 0 | 7 | -1.0 | CC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| 22266765 | 94588 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 30 | 4 | ChEMBL | 460 | 8 | 1 | 10 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccccc5)n4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252045 | 94588 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 30 | 4 | ChEMBL | 460 | 8 | 1 | 10 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccccc5)n4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 11952504 | 6020 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 34 | 3 | ChEMBL | 263 | 2 | 1 | 5 | 2.7 | c1coc(-c2nc3[nH]cnc3cc2-c2ccncn2)c1 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1080327 | 6020 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 34 | 3 | ChEMBL | 263 | 2 | 1 | 5 | 2.7 | c1coc(-c2nc3[nH]cnc3cc2-c2ccncn2)c1 | 10.1016/j.bmcl.2010.01.077 | |||
| 22266765 | 94588 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 30 | 4 | ChEMBL | 460 | 8 | 1 | 10 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccccc5)n4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL252045 | 94588 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 30 | 4 | ChEMBL | 460 | 8 | 1 | 10 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccccc5)n4)c3)nc2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11260448 | 135192 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 19 | 4 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(Cl)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL372084 | 135192 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 19 | 4 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(Cl)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 10029879 | 135193 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 61 | 2 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL372086 | 135193 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 61 | 2 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 21916408 | 159190 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 9 | 4 | ChEMBL | 378 | 5 | 1 | 7 | 2.0 | CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL409852 | 159190 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 9 | 4 | ChEMBL | 378 | 5 | 1 | 7 | 2.0 | CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 21916406 | 161453 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 4 | ChEMBL | 444 | 5 | 1 | 7 | 2.8 | Cn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL412747 | 161453 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 7 | 4 | ChEMBL | 444 | 5 | 1 | 7 | 2.8 | Cn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| 135444614 | 114735 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -40 | 4 | ChEMBL | 350 | 7 | 1 | 6 | 3.8 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(OCCC)cc3)nn12 | 10.1021/jm010570p | |||
| CHEMBL333860 | 114735 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -40 | 4 | ChEMBL | 350 | 7 | 1 | 6 | 3.8 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(OCCC)cc3)nn12 | 10.1021/jm010570p | |||
| 11640595 | 140190 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 9 | 2 | ChEMBL | 432 | 7 | 2 | 6 | 3.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc21 | 10.1021/jm0506221 | |||
| CHEMBL380481 | 140190 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 9 | 2 | ChEMBL | 432 | 7 | 2 | 6 | 3.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc21 | 10.1021/jm0506221 | |||
| 44450905 | 96018 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 48 | 2 | ChEMBL | 604 | 10 | 1 | 6 | 6.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259760 | 96018 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 48 | 2 | ChEMBL | 604 | 10 | 1 | 6 | 6.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 46228023 | 199908 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 382 | 6 | 0 | 8 | 2.4 | C=CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594735 | 199908 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 382 | 6 | 0 | 8 | 2.4 | C=CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 46227952 | 201143 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 412 | 6 | 0 | 7 | 2.6 | C=CCn1c(=O)c2c(nc(Cc3c(F)cccc3F)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL603209 | 201143 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 6 | 3 | ChEMBL | 412 | 6 | 0 | 7 | 2.6 | C=CCn1c(=O)c2c(nc(Cc3c(F)cccc3F)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 66893508 | 157094 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 505 | 9 | 1 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(OC)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4074473 | 157094 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 505 | 9 | 1 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(OC)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL5092037 | 215342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -2 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(N)nc1-c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 11584826 | 73032 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -1 | 2 | ChEMBL | 552 | 10 | 4 | 10 | 1.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)c4c(NC(=O)O)[nH]c(=O)n(C)c4=O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201026 | 73032 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -1 | 2 | ChEMBL | 552 | 10 | 4 | 10 | 1.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)c4c(NC(=O)O)[nH]c(=O)n(C)c4=O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 46837562 | 10720 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 496 | 7 | 3 | 5 | 3.9 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1170990 | 10720 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 496 | 7 | 3 | 5 | 3.9 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| 136396061 | 159030 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 510 | 9 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5ccc(F)cc5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4096730 | 159030 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 510 | 9 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5ccc(F)cc5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1016/j.bmc.2011.11.037 | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1016/j.bmc.2011.11.037 | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1016/j.bmc.2011.11.037 | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.7 | 5.7 | -389 | 5 | ChEMBL | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10.1016/j.bmc.2011.11.037 | |||
| 135489505 | 139742 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 344 | 6 | 1 | 7 | 1.9 | CCCn1c(=O)c2nc(-c3cc(C)nn3CC)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL379838 | 139742 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 344 | 6 | 1 | 7 | 1.9 | CCCn1c(=O)c2nc(-c3cc(C)nn3CC)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 52947452 | 19310 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 3 | 2 | ChEMBL | 558 | 9 | 2 | 5 | 4.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290543 | 19310 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 3 | 2 | ChEMBL | 558 | 9 | 2 | 5 | 4.7 | CS(=O)(=O)c1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 21874755 | 176890 | None | 1 | Human | Binding | pKi | = | 5.7 | 5.7 | -2 | 4 | ChEMBL | 336 | 4 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(C(=O)O)c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL461656 | 176890 | None | 1 | Human | Binding | pKi | = | 5.7 | 5.7 | -2 | 4 | ChEMBL | 336 | 4 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(C(=O)O)c3)c2n1 | 10.1021/jm800961g | |||
| 380 | 1286 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -17782 | 13 | ChEMBL | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10.1021/jm9905965 | |||
| 657378 | 1286 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -17782 | 13 | ChEMBL | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10.1021/jm9905965 | |||
| CHEMBL68738 | 1286 | None | 54 | Human | Binding | pKi | = | 4.7 | 4.7 | -17782 | 13 | ChEMBL | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10.1021/jm9905965 | |||
| 11610747 | 73119 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 53 | 2 | ChEMBL | 387 | 8 | 2 | 7 | 1.2 | COCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc21 | 10.1021/jm0506221 | |||
| CHEMBL201133 | 73119 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 53 | 2 | ChEMBL | 387 | 8 | 2 | 7 | 1.2 | COCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc21 | 10.1021/jm0506221 | |||
| 11510891 | 73407 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 2 | 2 | ChEMBL | 459 | 6 | 2 | 8 | 2.1 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccc(C#N)cc1 | 10.1021/jm0506221 | |||
| CHEMBL201585 | 73407 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | 2 | 2 | ChEMBL | 459 | 6 | 2 | 8 | 2.1 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccc(C#N)cc1 | 10.1021/jm0506221 | |||
| 162673131 | 182995 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 294 | 4 | 2 | 4 | 2.6 | CC1=C(C(=O)OCC(C)C)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4793530 | 182995 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 294 | 4 | 2 | 4 | 2.6 | CC1=C(C(=O)OCC(C)C)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 372 | 58 | None | 103 | Human | Binding | pKi | = | 4.7 | 4.7 | -2630 | 9 | ChEMBL | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10.1021/jm900413e | |||
| 8974 | 58 | None | 103 | Human | Binding | pKi | = | 4.7 | 4.7 | -2630 | 9 | ChEMBL | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10.1021/jm900413e | |||
| CHEMBL285819 | 58 | None | 103 | Human | Binding | pKi | = | 4.7 | 4.7 | -2630 | 9 | ChEMBL | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10.1021/jm900413e | |||
| 44410555 | 169011 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -15848 | 4 | ChEMBL | 450 | 6 | 4 | 9 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL439335 | 169011 | None | 0 | Human | Binding | pKi | = | 4.7 | 4.7 | -15848 | 4 | ChEMBL | 450 | 6 | 4 | 9 | 0.6 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 44390545 | 62507 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -5 | 3 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(F)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL178172 | 62507 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -5 | 3 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(F)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 44390545 | 62507 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -5 | 3 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(F)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL178172 | 62507 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -5 | 3 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(F)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 156011975 | 177311 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 340 | 3 | 1 | 7 | 3.3 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cncs1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4636932 | 177311 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 340 | 3 | 1 | 7 | 3.3 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cncs1 | 10.1021/acs.jmedchem.0c00564 | |||
| 10971806 | 56842 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -7 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3cccc(OC)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164381 | 56842 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -7 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3cccc(OC)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 145988962 | 167239 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 4 | ChEMBL | 635 | 17 | 2 | 10 | 4.2 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCNC3CCCCC3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4292514 | 167239 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 4 | ChEMBL | 635 | 17 | 2 | 10 | 4.2 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCNC3CCCCC3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 14978313 | 102653 | None | 0 | Rat | Binding | pKi | = | 5.7 | 5.7 | -4 | 5 | ChEMBL | 204 | 1 | 1 | 5 | -0.9 | C#CCn1c(=O)c2[nH]cnc2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL304455 | 102653 | None | 0 | Rat | Binding | pKi | = | 5.7 | 5.7 | -4 | 5 | ChEMBL | 204 | 1 | 1 | 5 | -0.9 | C#CCn1c(=O)c2[nH]cnc2n(C)c1=O | 10.1021/jm0104318 | |||
| 2867529 | 51888 | None | 8 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 236 | 2 | 2 | 4 | 1.1 | COC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1585743 | 51888 | None | 8 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 236 | 2 | 2 | 4 | 1.1 | COC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 2867529 | 51888 | None | 8 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 236 | 2 | 2 | 4 | 1.1 | COC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL1585743 | 51888 | None | 8 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 236 | 2 | 2 | 4 | 1.1 | COC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| 44307909 | 103062 | None | 1 | Human | Binding | pKi | = | 4.7 | 4.7 | - | 1 | ChEMBL | 219 | 1 | 0 | 7 | -1.0 | Cn1cnc2c1c(=O)n(CC#N)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL307326 | 103062 | None | 1 | Human | Binding | pKi | = | 4.7 | 4.7 | - | 1 | ChEMBL | 219 | 1 | 0 | 7 | -1.0 | Cn1cnc2c1c(=O)n(CC#N)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL5076095 | 214412 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -32 | 3 | ChEMBL | None | None | None | CCNc1nc(-c2ccccc2)c(C#N)c(-c2ccc3c(c2)OCO3)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 11560108 | 169065 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 387 | 6 | 1 | 8 | 1.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)c(OC)c1 | 10.1021/jm0506221 | |||
| CHEMBL439684 | 169065 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 387 | 6 | 1 | 8 | 1.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)c(OC)c1 | 10.1021/jm0506221 | |||
| 127038753 | 136655 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -165 | 3 | ChEMBL | 466 | 7 | 4 | 13 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1039/C5MD00086F | |||
| CHEMBL3740085 | 136655 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -165 | 3 | ChEMBL | 466 | 7 | 4 | 13 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1039/C5MD00086F | |||
| 11270783 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm900413e | |||
| 5615 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm900413e | |||
| CHEMBL260933 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm900413e | |||
| DB05936 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm900413e | |||
| 22266771 | 94622 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 417 | 6 | 2 | 8 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252272 | 94622 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 417 | 6 | 2 | 8 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cc(-c5ccccc5)on4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 10296638 | 36767 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -4 | 4 | ChEMBL | 434 | 4 | 2 | 7 | 4.8 | COc1ccc(NC(=O)Nc2nc3ccc(Cl)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL144979 | 36767 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -4 | 4 | ChEMBL | 434 | 4 | 2 | 7 | 4.8 | COc1ccc(NC(=O)Nc2nc3ccc(Cl)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 10296638 | 36767 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -4 | 4 | ChEMBL | 434 | 4 | 2 | 7 | 4.8 | COc1ccc(NC(=O)Nc2nc3ccc(Cl)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm0109614 | |||
| CHEMBL144979 | 36767 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -4 | 4 | ChEMBL | 434 | 4 | 2 | 7 | 4.8 | COc1ccc(NC(=O)Nc2nc3ccc(Cl)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm0109614 | |||
| 11826924 | 118743 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -1 | 4 | ChEMBL | 479 | 8 | 1 | 9 | 4.0 | O=C(COc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL341777 | 118743 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | -1 | 4 | ChEMBL | 479 | 8 | 1 | 9 | 4.0 | O=C(COc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 136042334 | 71159 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 33 | 2 | ChEMBL | 490 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)c(C)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955910 | 71159 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 33 | 2 | ChEMBL | 490 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C)c(C)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 136042344 | 71168 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 551 | 8 | 2 | 9 | 4.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955920 | 71168 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | - | 1 | ChEMBL | 551 | 8 | 2 | 9 | 4.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 21958701 | 72990 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | ChEMBL | 469 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(CC(=O)Nc4ccccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200780 | 72990 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | ChEMBL | 469 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(CC(=O)Nc4ccccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11270783 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm7014815 | |||
| 5615 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm7014815 | |||
| CHEMBL260933 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm7014815 | |||
| DB05936 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm7014815 | |||
| 24827444 | 96342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 14 | 3 | ChEMBL | 365 | 5 | 1 | 8 | 1.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4cccnc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL261526 | 96342 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 14 | 3 | ChEMBL | 365 | 5 | 1 | 8 | 1.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4cccnc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 21916394 | 160811 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 10 | 4 | ChEMBL | 458 | 6 | 1 | 7 | 3.2 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL411452 | 160811 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 10 | 4 | ChEMBL | 458 | 6 | 1 | 7 | 3.2 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| 49797774 | 10620 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 462 | 7 | 2 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(NS(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170137 | 10620 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 2 | 3 | ChEMBL | 462 | 7 | 2 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(NS(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 10237267 | 10800 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 373 | 4 | 1 | 5 | 3.7 | COc1ccc(N(C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171898 | 10800 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 373 | 4 | 1 | 5 | 3.7 | COc1ccc(N(C)C(C)=O)c2sc(NC(=O)c3ccc(F)cc3)nc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 9870396 | 139035 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 17 | 4 | ChEMBL | 494 | 7 | 1 | 7 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL378598 | 139035 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 17 | 4 | ChEMBL | 494 | 7 | 1 | 7 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11654461 | 139510 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL379474 | 139510 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 1 | 3 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11495984 | 72747 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 9 | 2 | ChEMBL | 444 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCc5ccccc54)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199884 | 72747 | None | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 9 | 2 | ChEMBL | 444 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCc5ccccc54)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11591823 | 74811 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 2 | ChEMBL | 528 | 9 | 2 | 6 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203148 | 74811 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 2 | ChEMBL | 528 | 9 | 2 | 6 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 10164201 | 123779 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(F)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL362268 | 123779 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(F)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 743242 | 172052 | None | 12 | Human | Binding | pKi | = | 6.7 | 6.7 | -38 | 3 | ChEMBL | 261 | 2 | 1 | 4 | 3.5 | N#Cc1c(-c2ccco2)cc(-c2ccccc2)nc1N | 10.1021/jm701594y | |||
| CHEMBL447192 | 172052 | None | 12 | Human | Binding | pKi | = | 6.7 | 6.7 | -38 | 3 | ChEMBL | 261 | 2 | 1 | 4 | 3.5 | N#Cc1c(-c2ccco2)cc(-c2ccccc2)nc1N | 10.1021/jm701594y | |||
| 853426 | 40977 | None | 11 | Human | Binding | pKi | = | 6.7 | 6.7 | -30 | 4 | ChEMBL | 264 | 2 | 2 | 5 | 2.5 | Nc1nc(-c2ccccc2)nc(-c2ccccc2O)n1 | 10.1021/jm3003069 | |||
| CHEMBL1487093 | 40977 | None | 11 | Human | Binding | pKi | = | 6.7 | 6.7 | -30 | 4 | ChEMBL | 264 | 2 | 2 | 5 | 2.5 | Nc1nc(-c2ccccc2)nc(-c2ccccc2O)n1 | 10.1021/jm3003069 | |||
| 135428628 | 141461 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -218 | 3 | ChEMBL | 357 | 3 | 2 | 4 | 2.5 | CCCN1C(=O)N2C[C@@H](C)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| CHEMBL384279 | 141461 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -218 | 3 | ChEMBL | 357 | 3 | 2 | 4 | 2.5 | CCCN1C(=O)N2C[C@@H](C)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| 9929470 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/acs.jmedchem.5b00551 | |||
| CHEMBL324735 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/acs.jmedchem.5b00551 | |||
| 9929470 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| CHEMBL324735 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| 9929470 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL324735 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.ejmech.2015.12.019 | |||
| 9929470 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL324735 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 9929470 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL324735 | 110471 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -44 | 4 | ChEMBL | 374 | 3 | 2 | 8 | 2.9 | Cn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 135874432 | 95796 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 517 | 8 | 2 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3nn(CC(=O)Nc4ccc(Cl)cc4)c(C)c3Cl)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258755 | 95796 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | - | 1 | ChEMBL | 517 | 8 | 2 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3nn(CC(=O)Nc4ccc(Cl)cc4)c(C)c3Cl)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 11058550 | 120129 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccccc1NC(=O)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm0109614 | |||
| CHEMBL351211 | 120129 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccccc1NC(=O)Nc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm0109614 | |||
| 15578103 | 176784 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 285 | 1 | 1 | 6 | 1.3 | Cc1ccc(-c2cc3c(c(=O)n(C)c(=O)n3C)n2O)cc1 | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL460617 | 176784 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | - | 1 | ChEMBL | 285 | 1 | 1 | 6 | 1.3 | Cc1ccc(-c2cc3c(c(=O)n(C)c(=O)n3C)n2O)cc1 | 10.1016/j.bmc.2008.09.067 | |||
| 71683092 | 89936 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -3 | 6 | ChEMBL | 340 | 5 | 1 | 5 | 3.2 | COc1cccc(CCC(=O)Nc2nc3ccccc3c(=O)s2)c1 | 10.1021/jm400336x | |||
| CHEMBL2380386 | 89936 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -3 | 6 | ChEMBL | 340 | 5 | 1 | 5 | 3.2 | COc1cccc(CCC(=O)Nc2nc3ccccc3c(=O)s2)c1 | 10.1021/jm400336x | |||
| 21874687 | 172639 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -15 | 4 | ChEMBL | 293 | 3 | 1 | 8 | 1.5 | Nc1nc(-c2ccco2)c2nnn(Cc3cccnc3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL449596 | 172639 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -15 | 4 | ChEMBL | 293 | 3 | 1 | 8 | 1.5 | Nc1nc(-c2ccco2)c2nnn(Cc3cccnc3)c2n1 | 10.1021/jm800961g | |||
| 11026434 | 57490 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 4 | ChEMBL | 433 | 5 | 2 | 10 | 3.3 | CCn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165910 | 57490 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -10 | 4 | ChEMBL | 433 | 5 | 2 | 10 | 3.3 | CCn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 10601859 | 119148 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 5 | ChEMBL | 512 | 7 | 2 | 8 | 5.7 | O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL342906 | 119148 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -1 | 5 | ChEMBL | 512 | 7 | 2 | 8 | 5.7 | O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 10453097 | 197891 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -20 | 4 | ChEMBL | 392 | 3 | 2 | 8 | 3.1 | Cn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL572765 | 197891 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -20 | 4 | ChEMBL | 392 | 3 | 2 | 8 | 3.1 | Cn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 21874676 | 189461 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -112 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc(F)cc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL513661 | 189461 | None | 0 | Human | Binding | pKi | = | 6.7 | 6.7 | -112 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc(F)cc3F)c2n1 | 10.1021/jm800961g | |||
| 11157262 | 123638 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -446 | 4 | ChEMBL | 560 | 8 | 5 | 14 | 0.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Br)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL361925 | 123638 | None | 0 | Human | Binding | pKi | = | 5.7 | 5.7 | -446 | 4 | ChEMBL | 560 | 8 | 5 | 14 | 0.2 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Br)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 9995603 | 100325 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -17 | 5 | ChEMBL | 311 | 5 | 1 | 4 | 3.0 | CCCn1c(=O)c2[nH]c(-c3ccccc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL289413 | 100325 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -17 | 5 | ChEMBL | 311 | 5 | 1 | 4 | 3.0 | CCCn1c(=O)c2[nH]c(-c3ccccc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11213889 | 206455 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -3 | 3 | ChEMBL | 485 | 8 | 2 | 9 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4cccc([N+](=O)[O-])c4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL8810 | 206455 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -3 | 3 | ChEMBL | 485 | 8 | 2 | 9 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4cccc([N+](=O)[O-])c4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| 10961304 | 76010 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -2 | 4 | ChEMBL | 447 | 6 | 3 | 10 | 3.4 | CCNc1c2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL20555 | 76010 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -2 | 4 | ChEMBL | 447 | 6 | 3 | 10 | 3.4 | CCNc1c2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL554955 | 76010 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -2 | 4 | ChEMBL | 447 | 6 | 3 | 10 | 3.4 | CCNc1c2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 137642862 | 158457 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 354 | 6 | 1 | 7 | 1.6 | CC#CCn1cc(-c2nc3c([nH]2)c(=O)n(CCC)c(=O)n3CCC)cn1 | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4090649 | 158457 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 354 | 6 | 1 | 7 | 1.6 | CC#CCn1cc(-c2nc3c([nH]2)c(=O)n(CCC)c(=O)n3CCC)cn1 | 10.1016/j.ejmech.2017.04.014 | |||
| 137661874 | 159300 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -60 | 3 | ChEMBL | 405 | 4 | 2 | 7 | 3.0 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4099688 | 159300 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -60 | 3 | ChEMBL | 405 | 4 | 2 | 7 | 3.0 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 66892501 | 156708 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 500 | 8 | 1 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C#N)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4070150 | 156708 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 500 | 8 | 1 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C#N)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 10310768 | 94563 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 466 | 7 | 2 | 9 | 2.8 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251878 | 94563 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 466 | 7 | 2 | 9 | 2.8 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.6 | 7.6 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm001047y | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.6 | 7.6 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm001047y | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.6 | 7.6 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm001047y | |||
| 11952560 | 6335 | None | 1 | Human | Binding | pKi | = | 7.6 | 7.6 | 20 | 3 | ChEMBL | 263 | 2 | 1 | 5 | 2.7 | c1coc(-c2nc3[nH]ncc3cc2-c2ccncn2)c1 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1082002 | 6335 | None | 1 | Human | Binding | pKi | = | 7.6 | 7.6 | 20 | 3 | ChEMBL | 263 | 2 | 1 | 5 | 2.7 | c1coc(-c2nc3[nH]ncc3cc2-c2ccncn2)c1 | 10.1016/j.bmcl.2010.01.077 | |||
| 44588518 | 174165 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 4 | 2 | ChEMBL | 317 | 5 | 2 | 6 | 2.3 | CCCn1c(=O)c2[nH]c(-c3ccco3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL454700 | 174165 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 4 | 2 | ChEMBL | 317 | 5 | 2 | 6 | 2.3 | CCCn1c(=O)c2[nH]c(-c3ccco3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 136042338 | 71162 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 12 | 2 | ChEMBL | 449 | 8 | 2 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955914 | 71162 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 12 | 2 | ChEMBL | 449 | 8 | 2 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5ccccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 49797750 | 10751 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 437 | 6 | 1 | 9 | 2.9 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cnnn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171349 | 10751 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 437 | 6 | 1 | 9 | 2.9 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4cnnn4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 21874571 | 189861 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -6 | 4 | ChEMBL | 325 | 3 | 2 | 8 | 1.8 | Nc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c(F)c1 | 10.1021/jm800961g | |||
| CHEMBL516800 | 189861 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -6 | 4 | ChEMBL | 325 | 3 | 2 | 8 | 1.8 | Nc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c(F)c1 | 10.1021/jm800961g | |||
| 156011786 | 177327 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnoc1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4637204 | 177327 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnoc1 | 10.1021/acs.jmedchem.0c00564 | |||
| 2874872 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL1566489 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.5b01586 | |||
| 2874872 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL1566489 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.7b00138 | |||
| 2874872 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1566489 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 2874872 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/ml400185v | |||
| CHEMBL1566489 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/ml400185v | |||
| 2874872 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL1566489 | 49672 | None | 14 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.9 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 168287172 | 191648 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(N=C=S)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5196082 | 191648 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(N=C=S)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 22282339 | 83102 | None | 3 | Human | Binding | pKi | = | 6.6 | 6.6 | -331 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| CHEMBL2181976 | 83102 | None | 3 | Human | Binding | pKi | = | 6.6 | 6.6 | -331 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| CHEMBL5084951 | 83102 | None | 3 | Human | Binding | pKi | = | 6.6 | 6.6 | -331 | 15 | ChEMBL | 386 | 4 | 1 | 5 | 5.1 | Cc1cc(C)cc(-c2nc(NC(=O)c3cccnc3)sc2-c2ccncc2)c1 | 10.1021/acsmedchemlett.1c00685 | |||
| 145960933 | 161560 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -2 | 3 | ChEMBL | 271 | 2 | 2 | 2 | 3.5 | O=C(Nc1nc2cccc(Cl)c2[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.8b00204 | |||
| CHEMBL4128848 | 161560 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -2 | 3 | ChEMBL | 271 | 2 | 2 | 2 | 3.5 | O=C(Nc1nc2cccc(Cl)c2[nH]1)c1ccccc1 | 10.1021/acs.jmedchem.8b00204 | |||
| 11493754 | 168759 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | 1 | 2 | ChEMBL | 336 | 3 | 1 | 7 | 0.9 | Cn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL437301 | 168759 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | 1 | 2 | ChEMBL | 336 | 3 | 1 | 7 | 0.9 | Cn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(C)c1=O | 10.1021/jm051268+ | |||
| 2519 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.6 | 4.6 | -1 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| 407 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.6 | 4.6 | -1 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| 463 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.6 | 4.6 | -1 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL113 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.6 | 4.6 | -1 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| DB00201 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.6 | 4.6 | -1 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| 44459944 | 94843 | None | 6 | Human | Binding | pKi | = | 4.6 | 4.6 | 1 | 3 | ChEMBL | 266 | 3 | 0 | 8 | -1.0 | CC(=O)OCCn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL25373 | 94843 | None | 6 | Human | Binding | pKi | = | 4.6 | 4.6 | 1 | 3 | ChEMBL | 266 | 3 | 0 | 8 | -1.0 | CC(=O)OCCn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| 11822168 | 203654 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | 3 | 4 | ChEMBL | 284 | 4 | 1 | 5 | 1.1 | Cn1c(=O)n(CCCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL67313 | 203654 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | 3 | 4 | ChEMBL | 284 | 4 | 1 | 5 | 1.1 | Cn1c(=O)n(CCCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 11702501 | 71498 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -501 | 3 | ChEMBL | 320 | 4 | 1 | 8 | 1.3 | Cn1c(-n2nccn2)nc2c(N)nc(CCc3ccccc3)nc21 | 10.1021/jm058018d | |||
| CHEMBL196259 | 71498 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -501 | 3 | ChEMBL | 320 | 4 | 1 | 8 | 1.3 | Cn1c(-n2nccn2)nc2c(N)nc(CCc3ccccc3)nc21 | 10.1021/jm058018d | |||
| 155556575 | 174498 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4554893 | 174498 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 135443302 | 116407 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 331 | 5 | 2 | 8 | 0.7 | CCCn1c(=O)c2nc(-c3cc(N)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33602 | 116407 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 2 | ChEMBL | 331 | 5 | 2 | 8 | 0.7 | CCCn1c(=O)c2nc(-c3cc(N)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11826577 | 57294 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -7 | 4 | ChEMBL | 456 | 4 | 2 | 8 | 4.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165044 | 57294 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -7 | 4 | ChEMBL | 456 | 4 | 2 | 8 | 4.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 99619 | 203469 | None | 23 | Human | Binding | pKi | = | 4.6 | 4.6 | - | 1 | ChEMBL | 223 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCN)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL66011 | 203469 | None | 23 | Human | Binding | pKi | = | 4.6 | 4.6 | - | 1 | ChEMBL | 223 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCN)n(C)c1=O | 10.1021/jm0104318 | |||
| 22375 | 203618 | None | 30 | Human | Binding | pKi | = | 4.6 | 4.6 | - | 1 | ChEMBL | 238 | 2 | 1 | 7 | -1.5 | Cn1cnc2c1c(=O)n(CC(=O)O)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL67109 | 203618 | None | 30 | Human | Binding | pKi | = | 4.6 | 4.6 | - | 1 | ChEMBL | 238 | 2 | 1 | 7 | -1.5 | Cn1cnc2c1c(=O)n(CC(=O)O)c(=O)n2C | 10.1021/jm0104318 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 6.6 | 6.6 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 6.6 | 6.6 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 6.6 | 6.6 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| 155550704 | 174304 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC(C)OC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4550201 | 174304 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC(C)OC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| 44410556 | 140547 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -10715 | 4 | ChEMBL | 404 | 5 | 5 | 10 | -1.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#C[C@H](C)O)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL381108 | 140547 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -10715 | 4 | ChEMBL | 404 | 5 | 5 | 10 | -1.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#C[C@H](C)O)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 44452493 | 96471 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -17 | 3 | ChEMBL | 307 | 4 | 0 | 6 | 3.4 | CCN(CC)c1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL262353 | 96471 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -17 | 3 | ChEMBL | 307 | 4 | 0 | 6 | 3.4 | CCN(CC)c1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 135416058 | 491 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| 442 | 491 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| CHEMBL2113342 | 491 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| 135416058 | 491 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| 442 | 491 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| CHEMBL2113342 | 491 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 10.1021/jm0309654 | |||
| 16071896 | 58023 | None | 44 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/jm201292w | |||
| CHEMBL1672627 | 58023 | None | 44 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/jm201292w | |||
| 10874051 | 84248 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -7 | 4 | ChEMBL | 450 | 5 | 2 | 10 | 3.6 | COc1ccc(NC(=O)Nc2nc3nn(C)c(SC)c3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm021023m | |||
| CHEMBL22113 | 84248 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -7 | 4 | ChEMBL | 450 | 5 | 2 | 10 | 3.6 | COc1ccc(NC(=O)Nc2nc3nn(C)c(SC)c3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm021023m | |||
| 66894080 | 158128 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 479 | 7 | 1 | 8 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(F)c5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4087056 | 158128 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 479 | 7 | 1 | 8 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(F)c5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 21958761 | 169417 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 66 | 2 | ChEMBL | 382 | 5 | 2 | 6 | 2.1 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL442434 | 169417 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 66 | 2 | ChEMBL | 382 | 5 | 2 | 6 | 2.1 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 11659696 | 85254 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 317 | 4 | 1 | 8 | 2.7 | c1coc(-c2nc(Nc3cncnc3)ncc2-c2ccncn2)c1 | 10.1021/jm061333v | |||
| CHEMBL225972 | 85254 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 317 | 4 | 1 | 8 | 2.7 | c1coc(-c2nc(Nc3cncnc3)ncc2-c2ccncn2)c1 | 10.1021/jm061333v | |||
| 16071896 | 58023 | None | 44 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672627 | 58023 | None | 44 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 44588474 | 175339 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 6 | 2 | ChEMBL | 357 | 6 | 2 | 6 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OC)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457418 | 175339 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 6 | 2 | ChEMBL | 357 | 6 | 2 | 6 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OC)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 44574254 | 173242 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 563 | 8 | 1 | 7 | 5.1 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL452454 | 173242 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 563 | 8 | 1 | 7 | 5.1 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 22266732 | 159346 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 514 | 7 | 1 | 10 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL410021 | 159346 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 514 | 7 | 1 | 10 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccc(C(F)(F)F)cc5)n4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 21874697 | 178586 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -12 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3c(F)cccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL467246 | 178586 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -12 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3c(F)cccc3F)c2n1 | 10.1021/jm800961g | |||
| 10404217 | 120097 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 19 | 5 | ChEMBL | 328 | 5 | 3 | 5 | 1.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(C(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL35094 | 120097 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 19 | 5 | ChEMBL | 328 | 5 | 3 | 5 | 1.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(C(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 16071896 | 58023 | None | 44 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1016/j.ejmech.2018.11.045 | |||
| CHEMBL1672627 | 58023 | None | 44 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 335 | 4 | 1 | 5 | 3.1 | O=C(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1016/j.ejmech.2018.11.045 | |||
| 137634776 | 155973 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 288 | 3 | 2 | 5 | 1.6 | CC1=C(C(=O)OC(C)C)C(c2ccco2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4061502 | 155973 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 288 | 3 | 2 | 5 | 1.6 | CC1=C(C(=O)OC(C)C)C(c2ccco2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 145975418 | 163850 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 7 | 4 | ChEMBL | 645 | 11 | 3 | 7 | 4.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4206556 | 163850 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 7 | 4 | ChEMBL | 645 | 11 | 3 | 7 | 4.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 11548714 | 73331 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 5 | 2 | ChEMBL | 572 | 9 | 2 | 6 | 5.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201321 | 73331 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 5 | 2 | ChEMBL | 572 | 9 | 2 | 6 | 5.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11628044 | 74693 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)c(Br)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203030 | 74693 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 538 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)c(Br)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451199 | 156866 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 10 | 3 | ChEMBL | 557 | 9 | 1 | 7 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL407179 | 156866 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 10 | 3 | ChEMBL | 557 | 9 | 1 | 7 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 162668796 | 182723 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 262 | 4 | 2 | 3 | 2.5 | CC1=C(C(=O)CC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4789729 | 182723 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 262 | 4 | 2 | 3 | 2.5 | CC1=C(C(=O)CC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 11597118 | 77090 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL207482 | 77090 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 44410585 | 77317 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -9999 | 4 | ChEMBL | 478 | 8 | 4 | 9 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CCCCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL208311 | 77317 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -9999 | 4 | ChEMBL | 478 | 8 | 4 | 9 | 1.4 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CCCCc4ccccc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 11761221 | 58155 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -50 | 4 | ChEMBL | 402 | 5 | 2 | 8 | 3.8 | CCCn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL168018 | 58155 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -50 | 4 | ChEMBL | 402 | 5 | 2 | 8 | 3.8 | CCCn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 18440425 | 198351 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -15 | 3 | ChEMBL | 282 | 5 | 2 | 6 | 2.1 | CCn1cnc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| CHEMBL576447 | 198351 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -15 | 3 | ChEMBL | 282 | 5 | 2 | 6 | 2.1 | CCn1cnc2c(N)nc(NCCc3ccccc3)nc21 | 10.1039/C5MD00034C | |||
| 9953799 | 203372 | None | 2 | Human | Binding | pKi | = | 6.6 | 6.6 | -47 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL65271 | 203372 | None | 2 | Human | Binding | pKi | = | 6.6 | 6.6 | -47 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 9953799 | 203372 | None | 2 | Human | Binding | pKi | = | 6.6 | 6.6 | -47 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm010818a | |||
| CHEMBL65271 | 203372 | None | 2 | Human | Binding | pKi | = | 6.6 | 6.6 | -47 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm010818a | |||
| 9953799 | 203372 | None | 2 | Human | Binding | pKi | = | 6.6 | 6.6 | -47 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL65271 | 203372 | None | 2 | Human | Binding | pKi | = | 6.6 | 6.6 | -47 | 4 | ChEMBL | 418 | 5 | 2 | 9 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11015003 | 57153 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -9 | 4 | ChEMBL | 406 | 4 | 2 | 8 | 3.5 | CCn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164685 | 57153 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -9 | 4 | ChEMBL | 406 | 4 | 2 | 8 | 3.5 | CCn1cc2c(nc(NC(=O)Nc3ccc(F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 44520980 | 199811 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -977 | 4 | ChEMBL | 311 | 4 | 2 | 6 | 1.9 | Cc1ccc(-c2cc(C(=O)NCc3cccn3C)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| CHEMBL594136 | 199811 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -977 | 4 | ChEMBL | 311 | 4 | 2 | 6 | 1.9 | Cc1ccc(-c2cc(C(=O)NCc3cccn3C)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| 44449532 | 96186 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -870 | 4 | ChEMBL | 318 | 3 | 1 | 7 | 2.8 | OC[C@@H]1CCCN1c1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| CHEMBL260718 | 96186 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -870 | 4 | ChEMBL | 318 | 3 | 1 | 7 | 2.8 | OC[C@@H]1CCCN1c1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| 9880392 | 189207 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -30 | 4 | ChEMBL | 326 | 3 | 1 | 7 | 2.7 | Nc1nc(-c2cccs2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL511405 | 189207 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -30 | 4 | ChEMBL | 326 | 3 | 1 | 7 | 2.7 | Nc1nc(-c2cccs2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 44410597 | 139219 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -3235 | 4 | ChEMBL | 496 | 7 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccc(OC)cc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL378810 | 139219 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -3235 | 4 | ChEMBL | 496 | 7 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccc(OC)cc4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 168278363 | 191163 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -169 | 3 | ChEMBL | 451 | 11 | 3 | 10 | 2.9 | Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)n3)c2n1 | 10.1016/j.ejmech.2022.114326 | |||
| CHEMBL5188801 | 191163 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -169 | 3 | ChEMBL | 451 | 11 | 3 | 10 | 2.9 | Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)n3)c2n1 | 10.1016/j.ejmech.2022.114326 | |||
| 11027412 | 29627 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 493 | 9 | 1 | 9 | 4.4 | O=C(COc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL138593 | 29627 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 493 | 9 | 1 | 9 | 4.4 | O=C(COc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 10895565 | 168450 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 445 | 8 | 1 | 9 | 3.8 | CC(C)CCn1cc2c(nc(NC(=O)COc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL435022 | 168450 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 445 | 8 | 1 | 9 | 3.8 | CC(C)CCn1cc2c(nc(NC(=O)COc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 16070337 | 58017 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 12 | 2 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672621 | 58017 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 12 | 2 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 136042332 | 71157 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 177 | 2 | ChEMBL | 598 | 8 | 2 | 9 | 4.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955908 | 71157 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 177 | 2 | ChEMBL | 598 | 8 | 2 | 9 | 4.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 22266769 | 157502 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 87 | 4 | ChEMBL | 513 | 7 | 1 | 9 | 3.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccc(C(F)(F)F)cc5)on4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL407969 | 157502 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 87 | 4 | ChEMBL | 513 | 7 | 1 | 9 | 3.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccc(C(F)(F)F)cc5)on4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 11690983 | 72638 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 2 | ChEMBL | 452 | 6 | 2 | 7 | 2.4 | COc1cc(OCC(=O)Nc2ccc(F)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL199485 | 72638 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 2 | ChEMBL | 452 | 6 | 2 | 7 | 2.4 | COc1cc(OCC(=O)Nc2ccc(F)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 11699025 | 73652 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -1 | 2 | ChEMBL | 503 | 10 | 3 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(N)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201791 | 73652 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -1 | 2 | ChEMBL | 503 | 10 | 3 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(N)=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451019 | 95863 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 27 | 2 | ChEMBL | 501 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259056 | 95863 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 27 | 2 | ChEMBL | 501 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 44451020 | 158843 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 26 | 2 | ChEMBL | 501 | 7 | 1 | 7 | 2.9 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL409481 | 158843 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 26 | 2 | ChEMBL | 501 | 7 | 1 | 7 | 2.9 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11511897 | 66100 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 8 | 2 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(OC)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL183915 | 66100 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 8 | 2 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(OC)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 1330 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| CHEMBL418333 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| CHEMBL435575 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| 1330 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm060277v | |||
| CHEMBL418333 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm060277v | |||
| CHEMBL435575 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm060277v | |||
| 9887859 | 113510 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| CHEMBL118923 | 113510 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| CHEMBL332091 | 113510 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -10000 | 6 | ChEMBL | 375 | 3 | 2 | 9 | 2.3 | Cn1cc2c(nc(NC(=O)Nc3ccncc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm020974x | |||
| 135874433 | 96089 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 561 | 8 | 2 | 8 | 3.9 | CCCn1c(=O)c2[nH]c(-c3nn(CC(=O)Nc4ccc(Cl)cc4)c(C)c3Br)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL260153 | 96089 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 561 | 8 | 2 | 8 | 3.9 | CCCn1c(=O)c2[nH]c(-c3nn(CC(=O)Nc4ccc(Cl)cc4)c(C)c3Br)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 11574428 | 138315 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -2 | 3 | ChEMBL | 379 | 5 | 3 | 8 | -1.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCCO)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| CHEMBL377106 | 138315 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -2 | 3 | ChEMBL | 379 | 5 | 3 | 8 | -1.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCCO)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| 1330 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| CHEMBL418333 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| CHEMBL435575 | 163216 | None | 45 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 6 | ChEMBL | 392 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| 11811544 | 57203 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -10 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1cccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)c1 | 10.1021/jm0109614 | |||
| CHEMBL164992 | 57203 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -10 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1cccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)c1 | 10.1021/jm0109614 | |||
| 44452434 | 160637 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -3 | 4 | ChEMBL | 369 | 4 | 1 | 6 | 3.7 | O=C(Cc1ccccc1)Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL411319 | 160637 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -3 | 4 | ChEMBL | 369 | 4 | 1 | 6 | 3.7 | O=C(Cc1ccccc1)Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 44452455 | 160840 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -2 | 4 | ChEMBL | 293 | 2 | 1 | 6 | 2.5 | CC(=O)Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL411482 | 160840 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -2 | 4 | ChEMBL | 293 | 2 | 1 | 6 | 2.5 | CC(=O)Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 44452431 | 96609 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -12 | 4 | ChEMBL | 345 | 3 | 1 | 7 | 3.4 | O=C(Nc1nc2ccccc2n2nc(-c3ccco3)nc12)c1ccco1 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL263370 | 96609 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -12 | 4 | ChEMBL | 345 | 3 | 1 | 7 | 3.4 | O=C(Nc1nc2ccccc2n2nc(-c3ccco3)nc12)c1ccco1 | 10.1016/j.bmc.2007.10.103 | |||
| 24827998 | 138995 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | - | 1 | ChEMBL | 249 | 3 | 1 | 4 | 1.7 | CCOC(=O)C1=C(C)NC(=O)CC1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785517 | 138995 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | - | 1 | ChEMBL | 249 | 3 | 1 | 4 | 1.7 | CCOC(=O)C1=C(C)NC(=O)CC1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| 9857698 | 176889 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -85 | 4 | ChEMBL | 306 | 3 | 1 | 7 | 2.4 | Cc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL461651 | 176889 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -85 | 4 | ChEMBL | 306 | 3 | 1 | 7 | 2.4 | Cc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 21958541 | 62994 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 19 | 3 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(C(F)(F)F)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL178662 | 62994 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 19 | 3 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(C(F)(F)F)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 176408 | 3555 | None | 84 | Human | Binding | pKi | = | 6.6 | 6.6 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01155 | |||
| 403 | 3555 | None | 84 | Human | Binding | pKi | = | 6.6 | 6.6 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01155 | |||
| 431 | 3555 | None | 84 | Human | Binding | pKi | = | 6.6 | 6.6 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01155 | |||
| CHEMBL17127 | 3555 | None | 84 | Human | Binding | pKi | = | 6.6 | 6.6 | -407 | 7 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01155 | |||
| 372 | 58 | None | 103 | Human | Binding | pKi | = | 4.6 | 4.6 | -2630 | 9 | ChEMBL | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10.1021/jm900413e | |||
| 8974 | 58 | None | 103 | Human | Binding | pKi | = | 4.6 | 4.6 | -2630 | 9 | ChEMBL | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10.1021/jm900413e | |||
| CHEMBL285819 | 58 | None | 103 | Human | Binding | pKi | = | 4.6 | 4.6 | -2630 | 9 | ChEMBL | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10.1021/jm900413e | |||
| 72546539 | 103851 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 2 | 2 | ChEMBL | 278 | 5 | 2 | 4 | 2.3 | CCCC1=C(C(=O)OCC)C(c2ccco2)NC(=O)N1 | 10.1021/ml400185v | |||
| CHEMBL3091711 | 103851 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 2 | 2 | ChEMBL | 278 | 5 | 2 | 4 | 2.3 | CCCC1=C(C(=O)OCC)C(c2ccco2)NC(=O)N1 | 10.1021/ml400185v | |||
| 9857266 | 176979 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -21 | 4 | ChEMBL | 293 | 3 | 1 | 8 | 1.5 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccn3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL462501 | 176979 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -21 | 4 | ChEMBL | 293 | 3 | 1 | 8 | 1.5 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccn3)c2n1 | 10.1021/jm800961g | |||
| 10155413 | 176887 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -117 | 4 | ChEMBL | 360 | 3 | 1 | 7 | 3.1 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(C(F)(F)F)c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL461649 | 176887 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -117 | 4 | ChEMBL | 360 | 3 | 1 | 7 | 3.1 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(C(F)(F)F)c3)c2n1 | 10.1021/jm800961g | |||
| 10051061 | 161535 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -10 | 3 | ChEMBL | 485 | 8 | 2 | 9 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL412854 | 161535 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -10 | 3 | ChEMBL | 485 | 8 | 2 | 9 | 2.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| 11071159 | 99507 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 12 | 2 | ChEMBL | 502 | 5 | 2 | 11 | 2.7 | COc1ccc(NC(=O)Nc2nc3nn(C)c(N4CCN(C)CC4)c3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm021023m | |||
| CHEMBL283319 | 99507 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 12 | 2 | ChEMBL | 502 | 5 | 2 | 11 | 2.7 | COc1ccc(NC(=O)Nc2nc3nn(C)c(N4CCN(C)CC4)c3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm021023m | |||
| 53321372 | 58025 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 353 | 4 | 1 | 5 | 3.2 | O=C(Nc1cnc(-c2c(F)cncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672629 | 58025 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 353 | 4 | 1 | 5 | 3.2 | O=C(Nc1cnc(-c2c(F)cncc2F)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 21958512 | 166524 | None | 1 | Human | Binding | pKi | = | 7.6 | 7.6 | 8 | 3 | ChEMBL | 396 | 6 | 1 | 7 | 2.3 | CCCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL427911 | 166524 | None | 1 | Human | Binding | pKi | = | 7.6 | 7.6 | 8 | 3 | ChEMBL | 396 | 6 | 1 | 7 | 2.3 | CCCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 11121771 | 100341 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 354 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(/C=C/C(=O)OC)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL289516 | 100341 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 354 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(/C=C/C(=O)OC)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 11676986 | 165752 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 11 | 2 | ChEMBL | 461 | 9 | 2 | 7 | 3.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccn4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL424671 | 165752 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 11 | 2 | ChEMBL | 461 | 9 | 2 | 7 | 3.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccn4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 46233378 | 200336 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 370 | 5 | 0 | 8 | 2.2 | CCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL597559 | 200336 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 3 | ChEMBL | 370 | 5 | 0 | 8 | 2.2 | CCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 16122818 | 57861 | None | 20 | Human | Binding | pKi | = | 6.6 | 6.6 | -44 | 3 | ChEMBL | 353 | 4 | 2 | 4 | 4.0 | CC(C)(C)CC(=O)Nc1c(F)cc(C(=O)Nc2nccs2)cc1F | 10.1021/jm1008659 | |||
| CHEMBL1671936 | 57861 | None | 20 | Human | Binding | pKi | = | 6.6 | 6.6 | -44 | 3 | ChEMBL | 353 | 4 | 2 | 4 | 4.0 | CC(C)(C)CC(=O)Nc1c(F)cc(C(=O)Nc2nccs2)cc1F | 10.1021/jm1008659 | |||
| 9801343 | 112422 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -41 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL329791 | 112422 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -41 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 9801343 | 112422 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -41 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm010818a | |||
| CHEMBL329791 | 112422 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -41 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm010818a | |||
| 9801343 | 112422 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -41 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm0109614 | |||
| CHEMBL329791 | 112422 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -41 | 4 | ChEMBL | 404 | 4 | 2 | 9 | 2.9 | COc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm0109614 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 11641051 | 168850 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 454 | 9 | 2 | 7 | 2.2 | COCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCCC4)cc3)cc21 | 10.1021/jm0506221 | |||
| CHEMBL438071 | 168850 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 1 | 2 | ChEMBL | 454 | 9 | 2 | 7 | 2.2 | COCCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCCC4)cc3)cc21 | 10.1021/jm0506221 | |||
| 44410402 | 76118 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -12882 | 4 | ChEMBL | 444 | 5 | 5 | 10 | -0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC4(O)CCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL205768 | 76118 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -12882 | 4 | ChEMBL | 444 | 5 | 5 | 10 | -0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC4(O)CCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 5604 | 3366 | None | 35 | Human | Binding | pKi | = | 6.6 | 6.6 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1039/C8MD00070K | |||
| 64627 | 3366 | None | 35 | Human | Binding | pKi | = | 6.6 | 6.6 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1039/C8MD00070K | |||
| CHEMBL52333 | 3366 | None | 35 | Human | Binding | pKi | = | 6.6 | 6.6 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1039/C8MD00070K | |||
| DB05360 | 3366 | None | 35 | Human | Binding | pKi | = | 6.6 | 6.6 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1039/C8MD00070K | |||
| 11674882 | 73395 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 359 | 5 | 2 | 7 | 0.7 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)O | 10.1021/jm0506221 | |||
| CHEMBL201547 | 73395 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 359 | 5 | 2 | 7 | 0.7 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)O | 10.1021/jm0506221 | |||
| 46228057 | 201329 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 3 | ChEMBL | 366 | 5 | 1 | 7 | 1.8 | C#CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL604283 | 201329 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 3 | ChEMBL | 366 | 5 | 1 | 7 | 1.8 | C#CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 11544894 | 96374 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 7 | 3 | ChEMBL | 354 | 3 | 1 | 7 | 1.0 | Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL261722 | 96374 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 7 | 3 | ChEMBL | 354 | 3 | 1 | 7 | 1.0 | Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 44450517 | 158333 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 6 | 3 | ChEMBL | 390 | 6 | 1 | 7 | 2.2 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL408936 | 158333 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 6 | 3 | ChEMBL | 390 | 6 | 1 | 7 | 2.2 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc21 | 10.1021/jm7014815 | |||
| 11544894 | 96374 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 7 | 3 | ChEMBL | 354 | 3 | 1 | 7 | 1.0 | Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL261722 | 96374 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 7 | 3 | ChEMBL | 354 | 3 | 1 | 7 | 1.0 | Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm051268+ | |||
| 155537221 | 172274 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4474714 | 172274 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1016/j.ejmech.2021.113907 | |||
| 155537221 | 172274 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4474714 | 172274 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11710918 | 138804 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 393 | 7 | 4 | 7 | -0.2 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCCO)cc3)nc2c1=O | 10.1021/jm060277v | |||
| CHEMBL378102 | 138804 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 393 | 7 | 4 | 7 | -0.2 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCCO)cc3)nc2c1=O | 10.1021/jm060277v | |||
| 11713242 | 72593 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 512 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199326 | 72593 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 512 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11590097 | 74486 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 8 | 2 | ChEMBL | 432 | 6 | 2 | 6 | 2.5 | CC(NC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)c1ccccc1 | 10.1021/jm0506221 | |||
| CHEMBL202828 | 74486 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 8 | 2 | ChEMBL | 432 | 6 | 2 | 6 | 2.5 | CC(NC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)c1ccccc1 | 10.1021/jm0506221 | |||
| 11548192 | 165996 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 524 | 10 | 2 | 7 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL425395 | 165996 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 2 | ChEMBL | 524 | 10 | 2 | 7 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451489 | 159072 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 22 | 2 | ChEMBL | 489 | 5 | 2 | 8 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(O)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL409725 | 159072 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 22 | 2 | ChEMBL | 489 | 5 | 2 | 8 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(O)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 46227973 | 199741 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 14 | 3 | ChEMBL | 400 | 7 | 0 | 9 | 1.8 | COCCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL593572 | 199741 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 14 | 3 | ChEMBL | 400 | 7 | 0 | 9 | 1.8 | COCCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 145964230 | 164009 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 461 | 10 | 3 | 6 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4208432 | 164009 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 461 | 10 | 3 | 6 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 9901171 | 176822 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -107 | 4 | ChEMBL | 307 | 3 | 2 | 8 | 1.7 | Nc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL461008 | 176822 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -107 | 4 | ChEMBL | 307 | 3 | 2 | 8 | 1.7 | Nc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.6 | 5.6 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.02.014 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.6 | 5.6 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.02.014 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.6 | 5.6 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.02.014 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.6 | 5.6 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.02.014 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.6 | 5.6 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.02.014 | |||
| 9858578 | 188984 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -31 | 4 | ChEMBL | 327 | 3 | 1 | 8 | 2.1 | Nc1nc(-c2nccs2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL508558 | 188984 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -31 | 4 | ChEMBL | 327 | 3 | 1 | 8 | 2.1 | Nc1nc(-c2nccs2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 10256007 | 122927 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -10 | 4 | ChEMBL | 516 | 8 | 5 | 14 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Cl)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL360646 | 122927 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -10 | 4 | ChEMBL | 516 | 8 | 5 | 14 | 0.1 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(Cl)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 145979285 | 166678 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 4 | ChEMBL | 604 | 16 | 1 | 11 | 3.2 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCn3ccnc3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4282002 | 166678 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -1 | 4 | ChEMBL | 604 | 16 | 1 | 11 | 3.2 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCn3ccnc3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 46228025 | 199945 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 416 | 8 | 1 | 8 | 2.9 | CCSCCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594970 | 199945 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 416 | 8 | 1 | 8 | 2.9 | CCSCCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 127034216 | 138959 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 287 | 3 | 1 | 6 | 2.7 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785215 | 138959 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 287 | 3 | 1 | 6 | 2.7 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 69550 | 204100 | None | 86 | Human | Binding | pKi | = | 4.6 | 4.6 | - | 1 | ChEMBL | 238 | 2 | 1 | 7 | -1.5 | Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL70246 | 204100 | None | 86 | Human | Binding | pKi | = | 4.6 | 4.6 | - | 1 | ChEMBL | 238 | 2 | 1 | 7 | -1.5 | Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O | 10.1021/jm0104318 | |||
| 156018530 | 177792 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2cnsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4643403 | 177792 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2cnsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 44390444 | 64931 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(OC)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL182259 | 64931 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(OC)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 70689262 | 77975 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -1202 | 4 | ChEMBL | 496 | 8 | 4 | 14 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL2096798 | 77975 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | -1202 | 4 | ChEMBL | 496 | 8 | 4 | 14 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](C)Cc5ccc(OC)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 135493281 | 109624 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 18 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(Cl)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32225 | 109624 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 18 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(Cl)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135493281 | 109624 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 18 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(Cl)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32225 | 109624 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 18 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 2.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(Cl)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 21958525 | 155556 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 432 | 5 | 2 | 6 | 3.0 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL404348 | 155556 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 432 | 5 | 2 | 6 | 3.0 | CC(C)Cn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 16720106 | 168883 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 346 | 4 | 1 | 8 | 2.6 | Cn1cc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)ccc1=O | 10.1021/jm061333v | |||
| CHEMBL438306 | 168883 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 346 | 4 | 1 | 8 | 2.6 | Cn1cc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)ccc1=O | 10.1021/jm061333v | |||
| 10906943 | 116528 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 479 | 7 | 1 | 8 | 5.1 | CC(C)CCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL336217 | 116528 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 479 | 7 | 1 | 8 | 5.1 | CC(C)CCn1cc2c(nc(NC(=O)Cc3cccc4ccccc34)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 46880372 | 5519 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 306 | 3 | 1 | 3 | 3.5 | O=C(Nc1ccc(Br)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1076562 | 5519 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 4 | ChEMBL | 306 | 3 | 1 | 3 | 3.5 | O=C(Nc1ccc(Br)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 135874429 | 95753 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 23 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258473 | 95753 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 23 | 2 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 135874414 | 96253 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 575 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(I)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261027 | 96253 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | - | 1 | ChEMBL | 575 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(I)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.6 | 7.6 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2015.12.019 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.6 | 7.6 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.6 | 7.6 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2015.12.019 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.6 | 7.6 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1016/j.ejmech.2015.12.019 | |||
| 50925499 | 19234 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 2 | ChEMBL | 523 | 9 | 2 | 5 | 5.9 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290101 | 19234 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 3 | 2 | ChEMBL | 523 | 9 | 2 | 5 | 5.9 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 52943652 | 19250 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290210 | 19250 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 1 | 3 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11589625 | 78245 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210649 | 78245 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | -1 | 3 | ChEMBL | 410 | 7 | 1 | 7 | 2.8 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11677252 | 73860 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 10 | 2 | ChEMBL | 475 | 10 | 2 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccncc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201895 | 73860 | None | 0 | Human | Binding | pKi | = | 7.6 | 7.6 | 10 | 2 | ChEMBL | 475 | 10 | 2 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccncc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11386134 | 67467 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -1995 | 5 | ChEMBL | 482 | 4 | 1 | 11 | 2.1 | Cn1nc(C(F)(F)F)c(CN2CCN(c3nc(N)n4nc(-c5ccco5)nc4n3)CC2)c1Cl | 10.1021/jm0498405 | |||
| CHEMBL189192 | 67467 | None | 0 | Human | Binding | pKi | = | 4.6 | 4.6 | -1995 | 5 | ChEMBL | 482 | 4 | 1 | 11 | 2.1 | Cn1nc(C(F)(F)F)c(CN2CCN(c3nc(N)n4nc(-c5ccco5)nc4n3)CC2)c1Cl | 10.1021/jm0498405 | |||
| 46233348 | 200296 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 6 | 2 | ChEMBL | 364 | 5 | 0 | 7 | 2.1 | CCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccccc2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL597355 | 200296 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 6 | 2 | ChEMBL | 364 | 5 | 0 | 7 | 2.1 | CCn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccccc2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 21874786 | 189837 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -93 | 4 | ChEMBL | 306 | 3 | 1 | 7 | 2.4 | Cc1ccccc1Cn1nnc2c(-c3ccco3)nc(N)nc21 | 10.1021/jm800961g | |||
| CHEMBL516611 | 189837 | None | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | -93 | 4 | ChEMBL | 306 | 3 | 1 | 7 | 2.4 | Cc1ccccc1Cn1nnc2c(-c3ccco3)nc(N)nc21 | 10.1021/jm800961g | |||
| 162676957 | 183534 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | - | 1 | ChEMBL | 306 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCC2CCC2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4800019 | 183534 | None | 0 | Human | Binding | pKi | = | 5.6 | 5.6 | - | 1 | ChEMBL | 306 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCC2CCC2)C(c2cccs2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 10993916 | 57154 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -12 | 4 | ChEMBL | 442 | 3 | 2 | 8 | 3.9 | Cn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164686 | 57154 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -12 | 4 | ChEMBL | 442 | 3 | 2 | 8 | 3.9 | Cn1cc2c(nc(NC(=O)Nc3ccc(C(F)(F)F)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 750351 | 189300 | None | 13 | Human | Binding | pKi | = | 6.5 | 6.5 | 5 | 2 | ChEMBL | 271 | 1 | 2 | 5 | 0.9 | Cn1c(=O)c2[nH]c(-c3ccccc3)c(O)c2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL512216 | 189300 | None | 13 | Human | Binding | pKi | = | 6.5 | 6.5 | 5 | 2 | ChEMBL | 271 | 1 | 2 | 5 | 0.9 | Cn1c(=O)c2[nH]c(-c3ccccc3)c(O)c2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11660427 | 73396 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 6 | 2 | ChEMBL | 357 | 5 | 1 | 7 | 1.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1021/jm0506221 | |||
| CHEMBL201548 | 73396 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 6 | 2 | ChEMBL | 357 | 5 | 1 | 7 | 1.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1021/jm0506221 | |||
| 12391837 | 9726 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 299 | 2 | 1 | 6 | 0.7 | CN(C)c1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm0104318 | |||
| CHEMBL11332 | 9726 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 299 | 2 | 1 | 6 | 0.7 | CN(C)c1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm0104318 | |||
| 25027416 | 64477 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 281 | 2 | 2 | 4 | 2.8 | O=C(Nc1ccc(O)cc1)c1coc2ccccc2c1=O | 10.1016/j.ejmech.2012.05.033 | |||
| CHEMBL1814064 | 64477 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 281 | 2 | 2 | 4 | 2.8 | O=C(Nc1ccc(O)cc1)c1coc2ccccc2c1=O | 10.1016/j.ejmech.2012.05.033 | |||
| 44236566 | 158977 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 484 | 6 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccccc4C(F)(F)F)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4096238 | 158977 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 484 | 6 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccccc4C(F)(F)F)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 16070220 | 58022 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 3 | 3 | ChEMBL | 307 | 4 | 1 | 6 | 2.5 | O=C(Nc1cnc(-c2ccncn2)c(-c2ccco2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672626 | 58022 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 3 | 3 | ChEMBL | 307 | 4 | 1 | 6 | 2.5 | O=C(Nc1cnc(-c2ccncn2)c(-c2ccco2)n1)C1CC1 | 10.1021/ml100249e | |||
| 11532717 | 77783 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(Cl)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL209174 | 77783 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(Cl)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 155524137 | 170880 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4454378 | 170880 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1016/j.ejmech.2021.113907 | |||
| 127030364 | 139137 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3787034 | 139137 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 127030364 | 139137 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3787034 | 139137 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 127030364 | 139137 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3787034 | 139137 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 156017721 | 177842 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2cnoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4644103 | 177842 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2cnoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 155524137 | 170880 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4454378 | 170880 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL5082973 | 214832 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 2 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(Nc2ccccc2)nc1-c1cccnc1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 127033325 | 139002 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3785618 | 139002 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.0c00564 | |||
| 127033325 | 139002 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785618 | 139002 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.5b01586 | |||
| 127033325 | 139002 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3785618 | 139002 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 10046145 | 2681 | None | 18 | Human | Binding | pKi | = | 5.5 | 5.5 | -575 | 6 | ChEMBL | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 10.1021/jm4011669 | |||
| 5610 | 2681 | None | 18 | Human | Binding | pKi | = | 5.5 | 5.5 | -575 | 6 | ChEMBL | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 10.1021/jm4011669 | |||
| CHEMBL413079 | 2681 | None | 18 | Human | Binding | pKi | = | 5.5 | 5.5 | -575 | 6 | ChEMBL | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 10.1021/jm4011669 | |||
| 52946159 | 19291 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 4 | 2 | ChEMBL | 493 | 9 | 2 | 4 | 5.7 | O=C(CCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290435 | 19291 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 4 | 2 | ChEMBL | 493 | 9 | 2 | 4 | 5.7 | O=C(CCc1ccccc1)NCc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11995649 | 141535 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -2 | 2 | ChEMBL | 473 | 8 | 1 | 8 | 1.9 | CCCn1c(=O)c2nc([C@]34CC[C@](C(=O)N(C)CC(=O)OC)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL384705 | 141535 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -2 | 2 | ChEMBL | 473 | 8 | 1 | 8 | 1.9 | CCCn1c(=O)c2nc([C@]34CC[C@](C(=O)N(C)CC(=O)OC)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 44417669 | 141651 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -37 | 4 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c(=O)c2nc(C34CC5CC(C3)C(C5)C4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL385372 | 141651 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -37 | 4 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c(=O)c2nc(C34CC5CC(C3)C(C5)C4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 11037972 | 57454 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -25 | 4 | ChEMBL | 466 | 4 | 2 | 8 | 4.2 | CCn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165600 | 57454 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -25 | 4 | ChEMBL | 466 | 4 | 2 | 8 | 4.2 | CCn1cc2c(nc(NC(=O)Nc3ccc(Br)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 5604 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| 64627 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL52333 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| DB05360 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | ChEMBL | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 10.1016/j.ejmech.2019.111879 | |||
| 18171064 | 103848 | None | 3 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 280 | 3 | 1 | 4 | 2.3 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccsc1 | 10.1021/ml400185v | |||
| CHEMBL3091706 | 103848 | None | 3 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 280 | 3 | 1 | 4 | 2.3 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccsc1 | 10.1021/ml400185v | |||
| 145979018 | 166620 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 609 | 15 | 1 | 11 | 2.2 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCOCC3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4280776 | 166620 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -1 | 3 | ChEMBL | 609 | 15 | 1 | 11 | 2.2 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCOCC3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 57429618 | 159076 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 392 | 4 | 2 | 6 | 1.9 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4097296 | 159076 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 392 | 4 | 2 | 6 | 1.9 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 69029783 | 156325 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 3 | 2 | ChEMBL | 570 | 9 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4065717 | 156325 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 3 | 2 | ChEMBL | 570 | 9 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44446477 | 155557 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 331 | 2 | ChEMBL | 430 | 5 | 2 | 6 | 2.8 | O=c1[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL404349 | 155557 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 331 | 2 | ChEMBL | 430 | 5 | 2 | 6 | 2.8 | O=c1[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| 44451330 | 96182 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 53 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260693 | 96182 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 53 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11952564 | 6044 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 26 | 3 | ChEMBL | 279 | 2 | 2 | 5 | 2.0 | O=c1[nH][nH]c2nc(-c3ccco3)c(-c3ccncn3)cc12 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1080497 | 6044 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 26 | 3 | ChEMBL | 279 | 2 | 2 | 5 | 2.0 | O=c1[nH][nH]c2nc(-c3ccco3)c(-c3ccncn3)cc12 | 10.1016/j.bmcl.2010.01.077 | |||
| 16072022 | 58011 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 5 | 4 | ChEMBL | 320 | 4 | 1 | 5 | 3.5 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CCC1 | 10.1021/ml100249e | |||
| CHEMBL1672615 | 58011 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 5 | 4 | ChEMBL | 320 | 4 | 1 | 5 | 3.5 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CCC1 | 10.1021/ml100249e | |||
| 45271361 | 195367 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 6 | 4 | ChEMBL | 495 | 10 | 2 | 8 | 2.8 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL551904 | 195367 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 6 | 4 | ChEMBL | 495 | 10 | 2 | 8 | 2.8 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 45269707 | 196071 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 4 | ChEMBL | 477 | 10 | 2 | 8 | 2.6 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL560624 | 196071 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 4 | ChEMBL | 477 | 10 | 2 | 8 | 2.6 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11568001 | 72628 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 3 | 4 | ChEMBL | 422 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199446 | 72628 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 3 | 4 | ChEMBL | 422 | 5 | 2 | 6 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44185936 | 185532 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 6 | ChEMBL | 522 | 8 | 3 | 7 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL486282 | 185532 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 6 | ChEMBL | 522 | 8 | 3 | 7 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 449 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 453 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 6603931 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL273807 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/acs.jmedchem.9b00071 | |||
| 11583705 | 73596 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 28 | 2 | ChEMBL | 474 | 10 | 2 | 6 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201773 | 73596 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 28 | 2 | ChEMBL | 474 | 10 | 2 | 6 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11503616 | 74694 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 41 | 2 | ChEMBL | 463 | 8 | 2 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)nc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203037 | 74694 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 41 | 2 | ChEMBL | 463 | 8 | 2 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC)nc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 9912816 | 98432 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 1 | 6 | ChEMBL | 475 | 10 | 2 | 7 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL275605 | 98432 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 1 | 6 | ChEMBL | 475 | 10 | 2 | 7 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11511593 | 141149 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 10 | 2 | ChEMBL | 494 | 9 | 2 | 6 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL382764 | 141149 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 10 | 2 | ChEMBL | 494 | 9 | 2 | 6 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44574168 | 178732 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 5 | 2 | ChEMBL | 394 | 4 | 2 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccco4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL468506 | 178732 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 5 | 2 | ChEMBL | 394 | 4 | 2 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccco4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 155531727 | 171664 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5F)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4466211 | 171664 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 512 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5F)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 11627336 | 140371 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 18 | 2 | ChEMBL | 492 | 9 | 2 | 6 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL380847 | 140371 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 18 | 2 | ChEMBL | 492 | 9 | 2 | 6 | 4.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 168287172 | 191648 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(N=C=S)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5196082 | 191648 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(N=C=S)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 145970075 | 164801 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 8 | 4 | ChEMBL | 475 | 11 | 3 | 6 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4218460 | 164801 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 8 | 4 | ChEMBL | 475 | 11 | 3 | 6 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 11677313 | 73293 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 3 | 2 | ChEMBL | 478 | 9 | 2 | 6 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201281 | 73293 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 3 | 2 | ChEMBL | 478 | 9 | 2 | 6 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451306 | 96263 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 117 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL261056 | 96263 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 117 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 449 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 453 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 6603931 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| CHEMBL273807 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | ChEMBL | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10.1021/jm900413e | |||
| 11642035 | 73542 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 7 | 5 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL201750 | 73542 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 7 | 5 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 11642035 | 73542 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 7 | 5 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL201750 | 73542 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 7 | 5 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| 44451305 | 160343 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 33 | 2 | ChEMBL | 551 | 5 | 1 | 7 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(Br)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL411075 | 160343 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 33 | 2 | ChEMBL | 551 | 5 | 1 | 7 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(Br)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11223 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.0c00564 | |||
| 17198004 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3787197 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.0c00564 | |||
| 11223 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.5b01586 | |||
| 17198004 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3787197 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.5b01586 | |||
| 11223 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.0c01431 | |||
| 17198004 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3787197 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.0c01431 | |||
| 11223 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.9b01340 | |||
| 17198004 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3787197 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | ChEMBL | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 10.1021/acs.jmedchem.9b01340 | |||
| 57429605 | 157181 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 488 | 8 | 1 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(=O)OCC)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4075650 | 157181 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 488 | 8 | 1 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C(=O)OCC)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 16072020 | 58009 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 4 | ChEMBL | 294 | 4 | 1 | 5 | 3.1 | CCC(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| CHEMBL1672613 | 58009 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 4 | ChEMBL | 294 | 4 | 1 | 5 | 3.1 | CCC(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| 136042339 | 71163 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 19 | 2 | ChEMBL | 483 | 8 | 2 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955915 | 71163 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 19 | 2 | ChEMBL | 483 | 8 | 2 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11590411 | 169089 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 446 | 6 | 2 | 7 | 2.5 | CC(=O)c1ccc(NC(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)cc1 | 10.1021/jm0506221 | |||
| CHEMBL439868 | 169089 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | - | 1 | ChEMBL | 446 | 6 | 2 | 7 | 2.5 | CC(=O)c1ccc(NC(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)cc1 | 10.1021/jm0506221 | |||
| 46837705 | 10622 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | -2 | 2 | ChEMBL | 496 | 7 | 3 | 5 | 3.9 | CCCn1c(=O)[nH]c2cc(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1170167 | 10622 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | -2 | 2 | ChEMBL | 496 | 7 | 3 | 5 | 3.9 | CCCn1c(=O)[nH]c2cc(-c3ccc(OCC(=O)Nc4ccc(Br)cc4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| 155549264 | 173818 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 26 | 2 | ChEMBL | 544 | 6 | 3 | 8 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(O)c(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4538468 | 173818 | None | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 26 | 2 | ChEMBL | 544 | 6 | 3 | 8 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(O)c(Cl)c5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 11605883 | 79950 | None | 6 | Human | Binding | pKi | = | 8.4 | 8.4 | 42 | 6 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL212625 | 79950 | None | 6 | Human | Binding | pKi | = | 8.4 | 8.4 | 42 | 6 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 57429602 | 157237 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4076435 | 157237 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 57988777 | 157089 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 529 | 8 | 1 | 8 | 4.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4074412 | 157089 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 529 | 8 | 1 | 8 | 4.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 50940969 | 57249 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 1 | 2 | ChEMBL | 363 | 6 | 1 | 5 | 4.2 | CCC(=O)Nc1cc(-c2ccc(OC)cc2)nc(-c2ccc(OC)cc2)n1 | 10.1021/acsmedchemlett.1c00598 | |||
| CHEMBL1650356 | 57249 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 1 | 2 | ChEMBL | 363 | 6 | 1 | 5 | 4.2 | CCC(=O)Nc1cc(-c2ccc(OC)cc2)nc(-c2ccc(OC)cc2)n1 | 10.1021/acsmedchemlett.1c00598 | |||
| 11605883 | 79950 | None | 6 | Human | Binding | pKi | = | 8.4 | 8.4 | 42 | 6 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm060277v | |||
| CHEMBL212625 | 79950 | None | 6 | Human | Binding | pKi | = | 8.4 | 8.4 | 42 | 6 | ChEMBL | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm060277v | |||
| 11525283 | 79663 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | 453 | 8 | 3 | 6 | 2.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccc4)cc3)nc2c1=O | 10.1021/jm060277v | |||
| CHEMBL211521 | 79663 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 2 | 5 | ChEMBL | 453 | 8 | 3 | 6 | 2.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCCc4ccccc4)cc3)nc2c1=O | 10.1021/jm060277v | |||
| 44451303 | 169152 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 50 | 2 | ChEMBL | 564 | 5 | 1 | 9 | 3.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL440418 | 169152 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 50 | 2 | ChEMBL | 564 | 5 | 1 | 9 | 3.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 156019075 | 177879 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1cocn1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4644677 | 177879 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2[C@@H]1c1cocn1 | 10.1021/acs.jmedchem.0c00564 | |||
| 57429607 | 159740 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 441 | 6 | 1 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C#N)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4104876 | 159740 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 441 | 6 | 1 | 8 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C#N)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 10926422 | 99642 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 4 | 4 | ChEMBL | 358 | 6 | 2 | 7 | 1.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)OC)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL284288 | 99642 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 4 | 4 | ChEMBL | 358 | 6 | 2 | 7 | 1.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)OC)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 456 | 349 | None | 59 | Human | Binding | pKi | = | 8.4 | 8.4 | 15 | 3 | ChEMBL | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 10.1021/jm058018d | |||
| 5372720 | 349 | None | 59 | Human | Binding | pKi | = | 8.4 | 8.4 | 15 | 3 | ChEMBL | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 10.1021/jm058018d | |||
| CHEMBL68500 | 349 | None | 59 | Human | Binding | pKi | = | 8.4 | 8.4 | 15 | 3 | ChEMBL | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 10.1021/jm058018d | |||
| 11143648 | 154849 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 1 | 3 | ChEMBL | 390 | 5 | 1 | 5 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(Br)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| CHEMBL40055 | 154849 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 1 | 3 | ChEMBL | 390 | 5 | 1 | 5 | 3.1 | CCCn1c(=O)c2nc(-c3ccc(Br)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm011049y | |||
| 11640539 | 140897 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | -1 | 4 | ChEMBL | 429 | 5 | 2 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL382135 | 140897 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | -1 | 4 | ChEMBL | 429 | 5 | 2 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11618962 | 72639 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 436 | 5 | 2 | 6 | 2.8 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccc(F)cc1 | 10.1021/jm0506221 | |||
| CHEMBL199486 | 72639 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 436 | 5 | 2 | 6 | 2.8 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccc(F)cc1 | 10.1021/jm0506221 | |||
| 10917575 | 81142 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -7 | 4 | ChEMBL | 463 | 5 | 1 | 11 | 2.9 | CSc1c2c(nc(NC(=O)Cc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL21572 | 81142 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -7 | 4 | ChEMBL | 463 | 5 | 1 | 11 | 2.9 | CSc1c2c(nc(NC(=O)Cc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 21958745 | 94729 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 432 | 6 | 2 | 6 | 3.1 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL253049 | 94729 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 432 | 6 | 2 | 6 | 3.1 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 10225178 | 32935 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -5 | 4 | ChEMBL | 438 | 3 | 2 | 6 | 5.5 | O=C(Nc1cccc(Cl)c1)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL141550 | 32935 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -5 | 4 | ChEMBL | 438 | 3 | 2 | 6 | 5.5 | O=C(Nc1cccc(Cl)c1)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 10225178 | 32935 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -5 | 4 | ChEMBL | 438 | 3 | 2 | 6 | 5.5 | O=C(Nc1cccc(Cl)c1)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm0109614 | |||
| CHEMBL141550 | 32935 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -5 | 4 | ChEMBL | 438 | 3 | 2 | 6 | 5.5 | O=C(Nc1cccc(Cl)c1)Nc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm0109614 | |||
| 11762982 | 26203 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 513 | 7 | 1 | 8 | 5.3 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL135719 | 26203 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 513 | 7 | 1 | 8 | 5.3 | O=C(Cc1cccc2ccccc12)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 46880470 | 6074 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 20 | 3 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(-c2cnco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1080676 | 6074 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 20 | 3 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(-c2cnco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46880506 | 6383 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 307 | 3 | 1 | 3 | 3.9 | CC(=O)Nc1ccc(-c2ccncc2)c(-c2cccc(F)c2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082208 | 6383 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 307 | 3 | 1 | 3 | 3.9 | CC(=O)Nc1ccc(-c2ccncc2)c(-c2cccc(F)c2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| 136042349 | 71147 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 21 | 2 | ChEMBL | 480 | 8 | 2 | 9 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955898 | 71147 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 21 | 2 | ChEMBL | 480 | 8 | 2 | 9 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 21958724 | 96199 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 8 | 3 | ChEMBL | 378 | 6 | 1 | 7 | 2.1 | CCCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL260763 | 96199 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 8 | 3 | ChEMBL | 378 | 6 | 1 | 7 | 2.1 | CCCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm0498405 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm0498405 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm0498405 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm0498405 | |||
| 44450903 | 96094 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 28 | 2 | ChEMBL | 532 | 7 | 1 | 8 | 3.0 | COc1ccc(C2CCN(C(=O)COc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3OC)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260179 | 96094 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 28 | 2 | ChEMBL | 532 | 7 | 1 | 8 | 3.0 | COc1ccc(C2CCN(C(=O)COc3ccc(-c4cc5c([nH]4)c(=O)n(C)c(=O)n5C)cc3OC)CC2)cc1 | 10.1016/j.bmc.2008.01.002 | |||
| 46837839 | 10754 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 464 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2c(cc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)n2C)n(C)c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1171380 | 10754 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 464 | 7 | 1 | 7 | 3.3 | CCCn1c(=O)c2c(cc(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)n2C)n(C)c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| 16109435 | 2377 | None | 10 | Human | Binding | pKi | = | 6.5 | 6.5 | -338 | 4 | ChEMBL | 353 | 3 | 1 | 2 | 6.3 | C1CCC(CC1)c1nc2c([nH]1)nc(cc2c1ccccc1)c1ccccc1 | 10.1021/jm0607956 | |||
| 5607 | 2377 | None | 10 | Human | Binding | pKi | = | 6.5 | 6.5 | -338 | 4 | ChEMBL | 353 | 3 | 1 | 2 | 6.3 | C1CCC(CC1)c1nc2c([nH]1)nc(cc2c1ccccc1)c1ccccc1 | 10.1021/jm0607956 | |||
| CHEMBL219160 | 2377 | None | 10 | Human | Binding | pKi | = | 6.5 | 6.5 | -338 | 4 | ChEMBL | 353 | 3 | 1 | 2 | 6.3 | C1CCC(CC1)c1nc2c([nH]1)nc(cc2c1ccccc1)c1ccccc1 | 10.1021/jm0607956 | |||
| 16109430 | 83418 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -489 | 3 | ChEMBL | 339 | 3 | 1 | 2 | 6.0 | c1ccc(-c2cc(-c3ccccc3)c3nc(C4CCCC4)[nH]c3n2)cc1 | 10.1021/jm0607956 | |||
| CHEMBL219625 | 83418 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -489 | 3 | ChEMBL | 339 | 3 | 1 | 2 | 6.0 | c1ccc(-c2cc(-c3ccccc3)c3nc(C4CCCC4)[nH]c3n2)cc1 | 10.1021/jm0607956 | |||
| 16109428 | 84278 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -489 | 4 | ChEMBL | 313 | 3 | 1 | 2 | 5.4 | CC(C)c1nc2c(-c3ccccc3)cc(-c3ccccc3)nc2[nH]1 | 10.1021/jm0607956 | |||
| CHEMBL221343 | 84278 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -489 | 4 | ChEMBL | 313 | 3 | 1 | 2 | 5.4 | CC(C)c1nc2c(-c3ccccc3)cc(-c3ccccc3)nc2[nH]1 | 10.1021/jm0607956 | |||
| 44418996 | 84303 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -549 | 4 | ChEMBL | 327 | 4 | 1 | 2 | 5.5 | CC(C)Cc1nc2c(-c3ccccc3)cc(-c3ccccc3)nc2[nH]1 | 10.1021/jm0607956 | |||
| CHEMBL221486 | 84303 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -549 | 4 | ChEMBL | 327 | 4 | 1 | 2 | 5.5 | CC(C)Cc1nc2c(-c3ccccc3)cc(-c3ccccc3)nc2[nH]1 | 10.1021/jm0607956 | |||
| 16109429 | 141606 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -346 | 4 | ChEMBL | 341 | 5 | 1 | 2 | 6.2 | CCC(CC)c1nc2c(-c3ccccc3)cc(-c3ccccc3)nc2[nH]1 | 10.1021/jm0607956 | |||
| CHEMBL385109 | 141606 | None | 1 | Human | Binding | pKi | = | 6.5 | 6.5 | -346 | 4 | ChEMBL | 341 | 5 | 1 | 2 | 6.2 | CCC(CC)c1nc2c(-c3ccccc3)cc(-c3ccccc3)nc2[nH]1 | 10.1021/jm0607956 | |||
| 11533237 | 77694 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 10 | 3 | ChEMBL | 488 | 7 | 1 | 7 | 4.1 | CC(C)Cn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL208920 | 77694 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 10 | 3 | ChEMBL | 488 | 7 | 1 | 7 | 4.1 | CC(C)Cn1c(=O)c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm051268+ | |||
| 135401232 | 3204 | None | 5 | Human | Binding | pKi | = | 4.5 | 4.5 | -24547 | 7 | ChEMBL | 397 | 2 | 1 | 3 | 4.4 | CC[C@H]1N=c2n(C1)c(=O)n(c1c2[nH]c(n1)c1cc(Cl)cc(c1Cl)Cl)C | 10.1016/j.ejmech.2019.111879 | |||
| 5619 | 3204 | None | 5 | Human | Binding | pKi | = | 4.5 | 4.5 | -24547 | 7 | ChEMBL | 397 | 2 | 1 | 3 | 4.4 | CC[C@H]1N=c2n(C1)c(=O)n(c1c2[nH]c(n1)c1cc(Cl)cc(c1Cl)Cl)C | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL1562432 | 3204 | None | 5 | Human | Binding | pKi | = | 4.5 | 4.5 | -24547 | 7 | ChEMBL | 397 | 2 | 1 | 3 | 4.4 | CC[C@H]1N=c2n(C1)c(=O)n(c1c2[nH]c(n1)c1cc(Cl)cc(c1Cl)Cl)C | 10.1016/j.ejmech.2019.111879 | |||
| 2519 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| 407 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| 463 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL113 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| DB00201 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.7b01627 | |||
| 10457445 | 103191 | None | 0 | Rat | Binding | pKi | = | 6.5 | 6.5 | -93 | 3 | ChEMBL | 470 | 14 | 4 | 6 | 5.0 | CCCN(CCCCCCN1CCC[C@@H]1Cc1ccc(O)c(O)c1)CCc1ccc(O)c(O)c1 | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL308295 | 103191 | None | 0 | Rat | Binding | pKi | = | 6.5 | 6.5 | -93 | 3 | ChEMBL | 470 | 14 | 4 | 6 | 5.0 | CCCN(CCCCCCN1CCC[C@@H]1Cc1ccc(O)c(O)c1)CCc1ccc(O)c(O)c1 | 10.1016/0960-894X(95)00413-N | |||
| 10905184 | 120138 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -30 | 4 | ChEMBL | 388 | 3 | 2 | 8 | 3.2 | Cc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm0109614 | |||
| CHEMBL351285 | 120138 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -30 | 4 | ChEMBL | 388 | 3 | 2 | 8 | 3.2 | Cc1ccc(NC(=O)Nc2nc3nn(C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm0109614 | |||
| 50940966 | 57282 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -30 | 3 | ChEMBL | 269 | 3 | 1 | 5 | 3.0 | CC(=O)Nc1cc(-c2ccoc2)nc(-c2ccoc2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650390 | 57282 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -30 | 3 | ChEMBL | 269 | 3 | 1 | 5 | 3.0 | CC(=O)Nc1cc(-c2ccoc2)nc(-c2ccoc2)n1 | 10.1021/jm100843z | |||
| 71680734 | 90211 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -13 | 6 | ChEMBL | 354 | 6 | 1 | 5 | 3.6 | COc1cccc(CCCC(=O)Nc2nc3ccccc3c(=O)s2)c1 | 10.1021/jm400336x | |||
| CHEMBL2382435 | 90211 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -13 | 6 | ChEMBL | 354 | 6 | 1 | 5 | 3.6 | COc1cccc(CCCC(=O)Nc2nc3ccccc3c(=O)s2)c1 | 10.1021/jm400336x | |||
| 135486118 | 111355 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 511 | 9 | 2 | 9 | 2.8 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32697 | 111355 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 511 | 9 | 2 | 9 | 2.8 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)nn3C)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| 10623248 | 112638 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -29 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL330286 | 112638 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -29 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 10623248 | 112638 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -29 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm010818a | |||
| CHEMBL330286 | 112638 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -29 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm010818a | |||
| 10623248 | 112638 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -29 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL330286 | 112638 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -29 | 4 | ChEMBL | 446 | 7 | 2 | 9 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 155522786 | 170750 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4452495 | 170750 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 10884803 | 120781 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -11 | 4 | ChEMBL | 447 | 6 | 2 | 10 | 3.7 | CCCn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL355415 | 120781 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -11 | 4 | ChEMBL | 447 | 6 | 2 | 10 | 3.7 | CCCn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 145991489 | 166838 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -2 | 4 | ChEMBL | 607 | 15 | 2 | 10 | 3.4 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCNC3CCCCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4285218 | 166838 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -2 | 4 | ChEMBL | 607 | 15 | 2 | 10 | 3.4 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCNC3CCCCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 162665544 | 182261 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 276 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC2CCC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4783746 | 182261 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 276 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC2CCC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 50940926 | 57232 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -6 | 4 | ChEMBL | 339 | 4 | 1 | 3 | 4.4 | CCC(=O)Nc1nc(-c2ccccc2F)cc(-c2ccccc2F)n1 | 10.1021/jm100843z | |||
| CHEMBL1650164 | 57232 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -6 | 4 | ChEMBL | 339 | 4 | 1 | 3 | 4.4 | CCC(=O)Nc1nc(-c2ccccc2F)cc(-c2ccccc2F)n1 | 10.1021/jm100843z | |||
| 10884000 | 75545 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 3 | ChEMBL | 405 | 6 | 1 | 9 | 3.7 | CSc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1CCCc1ccccc1 | 10.1021/jm021023m | |||
| CHEMBL20445 | 75545 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 3 | ChEMBL | 405 | 6 | 1 | 9 | 3.7 | CSc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1CCCc1ccccc1 | 10.1021/jm021023m | |||
| 11081189 | 120373 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 4 | ChEMBL | 470 | 5 | 2 | 8 | 5.1 | CCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL353299 | 120373 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 4 | ChEMBL | 470 | 5 | 2 | 8 | 5.1 | CCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11080491 | 22794 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 429 | 7 | 1 | 8 | 4.0 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| CHEMBL132806 | 22794 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 429 | 7 | 1 | 8 | 4.0 | CC(C)CCn1cc2c(nc(NC(=O)Cc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm030852k | |||
| 21916357 | 96391 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 10 | 4 | ChEMBL | 410 | 6 | 1 | 7 | 2.6 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL261819 | 96391 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 10 | 4 | ChEMBL | 410 | 6 | 1 | 7 | 2.6 | CCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| 21958764 | 96832 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 8 | 3 | ChEMBL | 378 | 6 | 1 | 7 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL265212 | 96832 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 8 | 3 | ChEMBL | 378 | 6 | 1 | 7 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4ccccc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL5086406 | 215025 | None | 3 | Human | Binding | pKi | = | 7.5 | 7.5 | -14 | 3 | ChEMBL | None | None | None | COc1cccc(-c2nc(N)nc(-c3ccccc3)c2C#N)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 156009568 | 177159 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 336 | 3 | 2 | 5 | 3.6 | CC1=C(C(=O)OC(C)C)C(c2ccc[nH]2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4634269 | 177159 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 336 | 3 | 2 | 5 | 3.6 | CC1=C(C(=O)OC(C)C)C(c2ccc[nH]2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 11568060 | 77877 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -17 | 3 | ChEMBL | 425 | 6 | 3 | 6 | 2.3 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Nc4ccccc4)cc3)nc2c1=O | 10.1021/jm060277v | |||
| CHEMBL209366 | 77877 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -17 | 3 | ChEMBL | 425 | 6 | 3 | 6 | 2.3 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Nc4ccccc4)cc3)nc2c1=O | 10.1021/jm060277v | |||
| 44451483 | 161125 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 5 | 2 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL411720 | 161125 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 5 | 2 | ChEMBL | 501 | 5 | 1 | 7 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 49798135 | 10873 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 521 | 7 | 2 | 7 | 4.5 | CCCn1c(=O)[nH]c2cc(-c3ccc(OCc4nc(-c5ccc(Br)cc5)no4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1172502 | 10873 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 521 | 7 | 2 | 7 | 4.5 | CCCn1c(=O)[nH]c2cc(-c3ccc(OCc4nc(-c5ccc(Br)cc5)no4)cc3)[nH]c2c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| 44308520 | 103596 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 348 | 5 | 1 | 5 | 2.7 | CCCn1c(=O)c2nc(-c3c(F)cccc3F)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL308660 | 103596 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 348 | 5 | 1 | 5 | 2.7 | CCCn1c(=O)c2nc(-c3c(F)cccc3F)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 11545341 | 78022 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 3 | ChEMBL | 378 | 6 | 1 | 7 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(-c4ccccc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL209831 | 78022 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 3 | ChEMBL | 378 | 6 | 1 | 7 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(-c4ccccc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 135428653 | 81567 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -295 | 4 | ChEMBL | 441 | 7 | 2 | 4 | 4.3 | CCCN1C(=O)N2C[C@@H](C(C)C)N=C2c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| CHEMBL216200 | 81567 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -295 | 4 | ChEMBL | 441 | 7 | 2 | 4 | 4.3 | CCCN1C(=O)N2C[C@@H](C(C)C)N=C2c2[nH]c(C34CCC(CCC(=O)O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| 11257336 | 201868 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -380 | 3 | ChEMBL | 374 | 5 | 1 | 6 | 2.3 | CCCn1c(=O)c2nc(C3=CC(C)(C)N([O])C3(C)C)[nH]c2n(CCC)c1=O | 10.1021/jm049513x | |||
| CHEMBL607302 | 201868 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -380 | 3 | ChEMBL | 374 | 5 | 1 | 6 | 2.3 | CCCn1c(=O)c2nc(C3=CC(C)(C)N([O])C3(C)C)[nH]c2n(CCC)c1=O | 10.1021/jm049513x | |||
| 11067937 | 203619 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 5 | 3 | ChEMBL | 344 | 5 | 0 | 6 | 2.0 | C=CCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL67110 | 203619 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 5 | 3 | ChEMBL | 344 | 5 | 0 | 6 | 2.0 | C=CCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 76309932 | 103840 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 292 | 3 | 1 | 5 | 1.7 | CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)C1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL3091696 | 103840 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 292 | 3 | 1 | 5 | 1.7 | CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)C1c1ccco1 | 10.1021/ml400185v | |||
| 3286 | 3207 | None | 31 | Rat | Binding | pKi | = | 5.5 | 5.5 | -26 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| 5311479 | 3207 | None | 31 | Rat | Binding | pKi | = | 5.5 | 5.5 | -26 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL8565 | 3207 | None | 31 | Rat | Binding | pKi | = | 5.5 | 5.5 | -26 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| 47104774 | 103847 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 296 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091705 | 103847 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 296 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 46227993 | 199695 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 326 | 4 | 1 | 7 | 1.2 | Cn1c(=O)c2[nH]c(Cc3ccco3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL593216 | 199695 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 326 | 4 | 1 | 7 | 1.2 | Cn1c(=O)c2[nH]c(Cc3ccco3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 395949 | 72503 | None | 18 | Human | Binding | pKi | = | 6.5 | 6.5 | -3 | 3 | ChEMBL | 218 | 2 | 2 | 4 | 1.0 | COc1cccc2cc(C(N)=O)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL1990267 | 72503 | None | 18 | Human | Binding | pKi | = | 6.5 | 6.5 | -3 | 3 | ChEMBL | 218 | 2 | 2 | 4 | 1.0 | COc1cccc2cc(C(N)=O)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 3288 | 1853 | None | 40 | Human | Binding | pKi | = | 4.5 | 4.5 | -10232 | 5 | ChEMBL | 351 | 4 | 5 | 10 | -1.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1CCC[C@@H]1O | 10.1007/s00044-004-0013-y | |||
| 9884817 | 1853 | None | 40 | Human | Binding | pKi | = | 4.5 | 4.5 | -10232 | 5 | ChEMBL | 351 | 4 | 5 | 10 | -1.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1CCC[C@@H]1O | 10.1007/s00044-004-0013-y | |||
| CHEMBL2163568 | 1853 | None | 40 | Human | Binding | pKi | = | 4.5 | 4.5 | -10232 | 5 | ChEMBL | 351 | 4 | 5 | 10 | -1.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H]1CCC[C@@H]1O | 10.1007/s00044-004-0013-y | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.1c00261 | |||
| 44520976 | 202189 | None | 4 | Human | Binding | pKi | = | 5.5 | 5.5 | -1258 | 4 | ChEMBL | 323 | 4 | 2 | 6 | 2.3 | Cc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1 | 10.1016/j.bmc.2009.07.078 | |||
| CHEMBL609578 | 202189 | None | 4 | Human | Binding | pKi | = | 5.5 | 5.5 | -1258 | 4 | ChEMBL | 323 | 4 | 2 | 6 | 2.3 | Cc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1 | 10.1016/j.bmc.2009.07.078 | |||
| 44520976 | 202189 | None | 4 | Human | Binding | pKi | = | 5.5 | 5.5 | -1258 | 4 | ChEMBL | 323 | 4 | 2 | 6 | 2.3 | Cc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1 | 10.1021/jm4011669 | |||
| CHEMBL609578 | 202189 | None | 4 | Human | Binding | pKi | = | 5.5 | 5.5 | -1258 | 4 | ChEMBL | 323 | 4 | 2 | 6 | 2.3 | Cc1cccc(CNC(=O)c2cc(-c3ccc(C)o3)nc(N)n2)n1 | 10.1021/jm4011669 | |||
| 135529386 | 489 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| 440 | 489 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| CHEMBL284615 | 489 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| 135529386 | 489 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| 440 | 489 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| CHEMBL284615 | 489 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 10.1021/jm0309654 | |||
| 46880422 | 6045 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 22 | 3 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(-c2ncco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1080500 | 6045 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 22 | 3 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(-c2ncco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 16070448 | 58018 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 9 | 2 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccncc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672622 | 58018 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 9 | 2 | ChEMBL | 317 | 4 | 1 | 5 | 2.9 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccncc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 44406643 | 133158 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 15 | 3 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(Cl)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL370380 | 133158 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 15 | 3 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(Cl)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 44451482 | 166884 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 16 | 3 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1cc(OCC(=O)N2CCN(c3ccccc3)CC2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL428605 | 166884 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 16 | 3 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1cc(OCC(=O)N2CCN(c3ccccc3)CC2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| 46227984 | 201292 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 4 | 3 | ChEMBL | 340 | 4 | 0 | 8 | 1.3 | Cn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL604075 | 201292 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 4 | 3 | ChEMBL | 340 | 4 | 0 | 8 | 1.3 | Cn1c(=O)c2c(nc(Cc3ccco3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 9843101 | 199101 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -7943 | 4 | ChEMBL | 385 | 6 | 1 | 7 | 3.9 | COc1cc(-c2nc(NC(C)=O)sc2-c2ccncc2)cc(OC)c1OC | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL589080 | 199101 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -7943 | 4 | ChEMBL | 385 | 6 | 1 | 7 | 3.9 | COc1cc(-c2nc(NC(C)=O)sc2-c2ccncc2)cc(OC)c1OC | 10.1016/j.ejmech.2019.111879 | |||
| 45268927 | 196143 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 342 | 7 | 1 | 6 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL561167 | 196143 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 2 | ChEMBL | 342 | 7 | 1 | 6 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 2732424 | 22190 | None | 29 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1cccs1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1322729 | 22190 | None | 29 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1cccs1 | 10.1021/acs.jmedchem.0c01431 | |||
| 44390559 | 65577 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 3 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5C(F)(F)F)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL183183 | 65577 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 3 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5C(F)(F)F)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 50940932 | 57241 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -8 | 4 | ChEMBL | 315 | 4 | 1 | 5 | 4.3 | CCC(=O)Nc1nc(-c2ccsc2)cc(-c2ccsc2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650347 | 57241 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -8 | 4 | ChEMBL | 315 | 4 | 1 | 5 | 4.3 | CCC(=O)Nc1nc(-c2ccsc2)cc(-c2ccsc2)n1 | 10.1021/jm100843z | |||
| 162675258 | 183353 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 9 | 2 | ChEMBL | 278 | 4 | 2 | 4 | 2.1 | CC1=C(C(=O)OCC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4797674 | 183353 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 9 | 2 | ChEMBL | 278 | 4 | 2 | 4 | 2.1 | CC1=C(C(=O)OCC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 46880509 | 6154 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 44 | 2 | ChEMBL | 316 | 4 | 1 | 4 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2cccnc2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081040 | 6154 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 44 | 2 | ChEMBL | 316 | 4 | 1 | 4 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2cccnc2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 11495161 | 78287 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 3 | ChEMBL | 406 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4C)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210747 | 78287 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 3 | ChEMBL | 406 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4C)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 541615 | 97523 | None | 1 | Human | Binding | pKi | = | 7.5 | 7.5 | -2 | 4 | ChEMBL | 385 | 8 | 2 | 7 | 1.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(N)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL27043 | 97523 | None | 1 | Human | Binding | pKi | = | 7.5 | 7.5 | -2 | 4 | ChEMBL | 385 | 8 | 2 | 7 | 1.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(N)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 45271363 | 195430 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 4 | ChEMBL | 478 | 10 | 2 | 9 | 2.0 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4cccnc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL552304 | 195430 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 4 | ChEMBL | 478 | 10 | 2 | 9 | 2.0 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4cccnc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11569877 | 133443 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 6 | 2 | ChEMBL | 518 | 11 | 3 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL370629 | 133443 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 6 | 2 | ChEMBL | 518 | 11 | 3 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 137639632 | 156919 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 439 | 7 | 1 | 9 | 0.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCOCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4072350 | 156919 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 439 | 7 | 1 | 9 | 0.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCOCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL5089580 | 215212 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -1174 | 4 | ChEMBL | None | None | None | Nc1nc(-c2ccc(OCCCN3CCCCC3)cc2)c2c(n1)-c1ccccc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||||
| 164617060 | 185407 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -363 | 4 | ChEMBL | 440 | 9 | 4 | 9 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.ejmech.2021.113607 | |||
| CHEMBL4861092 | 185407 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -363 | 4 | ChEMBL | 440 | 9 | 4 | 9 | 1.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCCCCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O | 10.1016/j.ejmech.2021.113607 | |||
| 22266740 | 96283 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 480 | 7 | 1 | 10 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL261182 | 96283 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 480 | 7 | 1 | 10 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 10861697 | 103036 | None | 0 | Rat | Binding | pKi | = | 5.5 | 5.5 | -4 | 4 | ChEMBL | 374 | 7 | 0 | 6 | 3.1 | CCCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL307105 | 103036 | None | 0 | Rat | Binding | pKi | = | 5.5 | 5.5 | -4 | 4 | ChEMBL | 374 | 7 | 0 | 6 | 3.1 | CCCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(CCC)c1=O | 10.1021/jm0104318 | |||
| 1241166 | 199282 | None | 21 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | ChEMBL | 356 | 5 | 1 | 4 | 5.8 | O=C(c1ccccc1)c1sc(Nc2ccccc2)nc1-c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL590302 | 199282 | None | 21 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | ChEMBL | 356 | 5 | 1 | 4 | 5.8 | O=C(c1ccccc1)c1sc(Nc2ccccc2)nc1-c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| 127043829 | 141216 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -1 | 4 | ChEMBL | 552 | 13 | 0 | 10 | 3.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN3CCOCC3)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3828555 | 141216 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -1 | 4 | ChEMBL | 552 | 13 | 0 | 10 | 3.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN3CCOCC3)cc2)n(CCCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 44587954 | 174431 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | ChEMBL | 371 | 6 | 3 | 6 | 2.4 | CCCn1c(=O)c2[nH]c(-c3ccc(C(=O)O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL455315 | 174431 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | ChEMBL | 371 | 6 | 3 | 6 | 2.4 | CCCn1c(=O)c2[nH]c(-c3ccc(C(=O)O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 127043664 | 141205 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 4 | ChEMBL | 510 | 13 | 0 | 9 | 3.4 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3828401 | 141205 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 1 | 4 | ChEMBL | 510 | 13 | 0 | 9 | 3.4 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 52950000 | 19124 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | ChEMBL | 505 | 8 | 2 | 4 | 5.2 | N#Cc1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289344 | 19124 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | ChEMBL | 505 | 8 | 2 | 4 | 5.2 | N#Cc1c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)ccc2[nH]c1=O | 10.1016/j.bmcl.2010.10.030 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1039/C8MD00070K | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1039/C8MD00070K | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1039/C8MD00070K | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1039/C8MD00070K | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1039/C8MD00070K | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.5b01586 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.5b01586 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.5b01586 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/acs.jmedchem.5b01586 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2016.09.003 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2016.09.003 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2016.09.003 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2016.09.003 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2016.09.003 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2013.09.044 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2010.01.072 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2010.01.072 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2010.01.072 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2010.01.072 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2019.111879 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2019.111879 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2019.111879 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2019.111879 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm900413e | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2019.02.004 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2019.02.004 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2019.02.004 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2019.02.004 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | ChEMBL | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2019.02.004 | |||
| 44459941 | 96696 | None | 4 | Human | Binding | pKi | = | 5.5 | 5.5 | 1 | 3 | ChEMBL | 246 | 4 | 0 | 6 | 0.3 | C=CCn1c(=O)c2c(ncn2C)n(CC=C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL26406 | 96696 | None | 4 | Human | Binding | pKi | = | 5.5 | 5.5 | 1 | 3 | ChEMBL | 246 | 4 | 0 | 6 | 0.3 | C=CCn1c(=O)c2c(ncn2C)n(CC=C)c1=O | 10.1021/jm0104318 | |||
| 10563436 | 135228 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 262 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(C3CCCC3)nc2c1=O | 10.1021/jm0104318 | |||
| CHEMBL37243 | 135228 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 262 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(C3CCCC3)nc2c1=O | 10.1021/jm0104318 | |||
| 136002186 | 109699 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32281 | 109699 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 136002186 | 109699 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32281 | 109699 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 21958725 | 94560 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 3 | 4 | ChEMBL | 364 | 6 | 2 | 6 | 2.1 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251874 | 94560 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 3 | 4 | ChEMBL | 364 | 6 | 2 | 6 | 2.1 | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 11667107 | 144391 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 332 | 4 | 1 | 7 | 2.6 | [O-][n+]1cccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)c1 | 10.1021/jm061333v | |||
| CHEMBL390600 | 144391 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 332 | 4 | 1 | 7 | 2.6 | [O-][n+]1cccc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)c1 | 10.1021/jm061333v | |||
| 11812897 | 120297 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 3 | 4 | ChEMBL | 484 | 6 | 2 | 8 | 5.5 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL352707 | 120297 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 3 | 4 | ChEMBL | 484 | 6 | 2 | 8 | 5.5 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 2817165 | 188819 | None | 5 | Human | Binding | pKi | = | 7.5 | 7.5 | -91 | 3 | ChEMBL | 251 | 2 | 1 | 5 | 3.1 | N#Cc1c(-c2ccco2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| CHEMBL506250 | 188819 | None | 5 | Human | Binding | pKi | = | 7.5 | 7.5 | -91 | 3 | ChEMBL | 251 | 2 | 1 | 5 | 3.1 | N#Cc1c(-c2ccco2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| 11524637 | 78085 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 3 | ChEMBL | 422 | 8 | 1 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(OC)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210150 | 78085 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -1 | 3 | ChEMBL | 422 | 8 | 1 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(OC)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 10563436 | 135228 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 262 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(C3CCCC3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37243 | 135228 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -3 | 3 | ChEMBL | 262 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(C3CCCC3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL5088749 | 215174 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -11 | 3 | ChEMBL | None | None | None | CNc1nc(-c2ccccc2)c(C#N)c(-c2cccc(C#N)c2)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 11656950 | 72282 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | 557 | 10 | 2 | 8 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C5=NC(C)(C)CO5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL198294 | 72282 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 2 | ChEMBL | 557 | 10 | 2 | 8 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C5=NC(C)(C)CO5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11569133 | 72610 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 2 | ChEMBL | 476 | 9 | 3 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199399 | 72610 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 2 | ChEMBL | 476 | 9 | 3 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 156019760 | 177946 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -40 | 2 | ChEMBL | 337 | 3 | 2 | 6 | 3.0 | CC1=C(C(=O)OC(C)C)C(c2cn[nH]c2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4645687 | 177946 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -40 | 2 | ChEMBL | 337 | 3 | 2 | 6 | 3.0 | CC1=C(C(=O)OC(C)C)C(c2cn[nH]c2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 145986838 | 167081 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -2 | 3 | ChEMBL | 581 | 16 | 1 | 10 | 2.9 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN(CC)CC)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4289660 | 167081 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -2 | 3 | ChEMBL | 581 | 16 | 1 | 10 | 2.9 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN(CC)CC)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 135465784 | 162860 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 495 | 9 | 3 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(O)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL417312 | 162860 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 495 | 9 | 3 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(O)c(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 72546540 | 103839 | None | 1 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 248 | 3 | 1 | 5 | 1.5 | CCOC(=O)c1c(-c2ccco2)nc(=O)[nH]c1C | 10.1021/ml400185v | |||
| CHEMBL3091695 | 103839 | None | 1 | Human | Binding | pKi | = | 5.5 | 5.5 | - | 1 | ChEMBL | 248 | 3 | 1 | 5 | 1.5 | CCOC(=O)c1c(-c2ccco2)nc(=O)[nH]c1C | 10.1021/ml400185v | |||
| 137652737 | 158587 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 304 | 3 | 2 | 5 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2cccs2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4092030 | 158587 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 304 | 3 | 2 | 5 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2cccs2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL5076343 | 214427 | None | 3 | Human | Binding | pKi | = | 6.5 | 6.5 | -158 | 3 | ChEMBL | None | None | None | Nc1ccccc1NC(=O)c1ccc(CCn2ncc3c2nc(N)n2nc(-c4ccco4)nc32)cc1 | 10.1021/acs.jmedchem.1c01155 | |||||
| 135493268 | 110484 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 25 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32481 | 110484 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 25 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135493268 | 110484 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 25 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32481 | 110484 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 25 | 2 | ChEMBL | 449 | 8 | 2 | 8 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccccc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10926253 | 81056 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 3 | ChEMBL | 353 | 2 | 1 | 10 | 0.6 | CN1CCN(c2c3c(nc(N)n4nc(-c5ccco5)nc34)nn2C)CC1 | 10.1021/jm021023m | |||
| CHEMBL21541 | 81056 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 3 | ChEMBL | 353 | 2 | 1 | 10 | 0.6 | CN1CCN(c2c3c(nc(N)n4nc(-c5ccco5)nc34)nn2C)CC1 | 10.1021/jm021023m | |||
| CHEMBL553587 | 81056 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 3 | ChEMBL | 353 | 2 | 1 | 10 | 0.6 | CN1CCN(c2c3c(nc(N)n4nc(-c5ccco5)nc34)nn2C)CC1 | 10.1021/jm021023m | |||
| 11733496 | 24903 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 477 | 8 | 1 | 8 | 4.5 | O=C(Cc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL134566 | 24903 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 1 | 4 | ChEMBL | 477 | 8 | 1 | 8 | 4.5 | O=C(Cc1ccccc1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 10994216 | 194917 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -2 | 4 | ChEMBL | 463 | 7 | 1 | 8 | 4.2 | O=C(Cc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL541455 | 194917 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | -2 | 4 | ChEMBL | 463 | 7 | 1 | 8 | 4.2 | O=C(Cc1ccccc1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 44587955 | 188945 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 11 | 2 | ChEMBL | 397 | 7 | 2 | 8 | 1.8 | CCCn1c(=O)c2[nH]c(-c3ccco3)c(OS(=O)(=O)O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL508090 | 188945 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 11 | 2 | ChEMBL | 397 | 7 | 2 | 8 | 1.8 | CCCn1c(=O)c2[nH]c(-c3ccco3)c(OS(=O)(=O)O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 136042342 | 71166 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 8 | 2 | ChEMBL | 479 | 9 | 2 | 10 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955918 | 71166 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 8 | 2 | ChEMBL | 479 | 9 | 2 | 10 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(OC)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135874415 | 95892 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 527 | 8 | 2 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Br)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL259177 | 95892 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | - | 1 | ChEMBL | 527 | 8 | 2 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Br)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 11956193 | 94575 | None | 9 | Human | Binding | pKi | = | 7.5 | 7.5 | -12 | 5 | ChEMBL | 367 | 5 | 1 | 8 | 1.1 | CN1CCN(CC(=O)Nc2cc(-n3cccn3)nc(-c3ccco3)n2)CC1 | 10.1021/jm070623o | |||
| CHEMBL251975 | 94575 | None | 9 | Human | Binding | pKi | = | 7.5 | 7.5 | -12 | 5 | ChEMBL | 367 | 5 | 1 | 8 | 1.1 | CN1CCN(CC(=O)Nc2cc(-n3cccn3)nc(-c3ccco3)n2)CC1 | 10.1021/jm070623o | |||
| 24828457 | 96833 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 27 | 4 | ChEMBL | 396 | 6 | 1 | 7 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL265213 | 96833 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 27 | 4 | ChEMBL | 396 | 6 | 1 | 7 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 11647607 | 78092 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 4 | 3 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)c(F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210212 | 78092 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 4 | 3 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)c(F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 1153 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 12668023 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 30026874 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 30026875 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 3341 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 6603851 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 933 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 939 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 985 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL1160786 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL1161520 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL588 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| DB00800 | 1626 | None | 58 | Rat | Binding | pKi | = | 7.5 | 7.5 | -5 | 10 | ChEMBL | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | 10.1016/0960-894X(95)00413-N | |||
| 46227951 | 199943 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 396 | 6 | 0 | 8 | 2.6 | Cn1c(Cc2cccs2)nc2c1c(=O)n(CC1CC1)c(=O)n2Cc1ccco1 | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594963 | 199943 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 396 | 6 | 0 | 8 | 2.6 | Cn1c(Cc2cccs2)nc2c1c(=O)n(CC1CC1)c(=O)n2Cc1ccco1 | 10.1016/j.bmc.2009.07.034 | |||
| 46233377 | 201256 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 386 | 5 | 0 | 8 | 2.7 | CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL603878 | 201256 | None | 0 | Human | Binding | pKi | = | 7.5 | 7.5 | 2 | 3 | ChEMBL | 386 | 5 | 0 | 8 | 2.7 | CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2cccs2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 135423046 | 37702 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -77 | 4 | ChEMBL | 390 | 4 | 3 | 8 | 2.9 | COc1ccc(NC(=O)Nc2nc3n[nH]cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL145767 | 37702 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -77 | 4 | ChEMBL | 390 | 4 | 3 | 8 | 2.9 | COc1ccc(NC(=O)Nc2nc3n[nH]cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 11642231 | 77491 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 528 | 7 | 1 | 7 | 4.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)cc(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL208723 | 77491 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 528 | 7 | 1 | 7 | 4.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)cc(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 135633268 | 138972 | None | 8 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 288 | 3 | 1 | 7 | 2.1 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2ncnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785325 | 138972 | None | 8 | Human | Binding | pKi | = | 6.5 | 6.5 | - | 1 | ChEMBL | 288 | 3 | 1 | 7 | 2.1 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)n2ncnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 5613 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | ChEMBL | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 10.1021/jm4011669 | |||
| 9860294 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | ChEMBL | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 10.1021/jm4011669 | |||
| CHEMBL197669 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | ChEMBL | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 10.1021/jm4011669 | |||
| 5613 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | ChEMBL | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 10.1021/jm058018d | |||
| 9860294 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | ChEMBL | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 10.1021/jm058018d | |||
| CHEMBL197669 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | ChEMBL | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 10.1021/jm058018d | |||
| 72697652 | 104014 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -26 | 5 | ChEMBL | 349 | 3 | 0 | 7 | 0.9 | C#CCn1c(=O)c2c(nc3n2CCCN3Cc2ccccc2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093310 | 104014 | None | 0 | Human | Binding | pKi | = | 5.5 | 5.5 | -26 | 5 | ChEMBL | 349 | 3 | 0 | 7 | 0.9 | C#CCn1c(=O)c2c(nc3n2CCCN3Cc2ccccc2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 10254700 | 203524 | None | 6 | Human | Binding | pKi | = | 5.5 | 5.5 | -478 | 8 | ChEMBL | 483 | 5 | 4 | 9 | 0.7 | OC[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9905965 | |||
| CHEMBL66393 | 203524 | None | 6 | Human | Binding | pKi | = | 5.5 | 5.5 | -478 | 8 | ChEMBL | 483 | 5 | 4 | 9 | 0.7 | OC[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)ncnc32)[C@H](O)[C@@H]1O | 10.1021/jm9905965 | |||
| CHEMBL5078609 | 214567 | None | 0 | Human | Binding | pKi | = | 6.5 | 6.5 | -12 | 2 | ChEMBL | None | None | None | CNc1nc(-c2ccccc2)c(C#N)c(-c2cccc(F)c2)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 135443359 | 490 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 441 | 490 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL431703 | 490 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 135443359 | 490 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 441 | 490 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL431703 | 490 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 10859484 | 77656 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -5 | 4 | ChEMBL | 298 | 3 | 2 | 9 | 1.3 | CCNc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL20888 | 77656 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -5 | 4 | ChEMBL | 298 | 3 | 2 | 9 | 1.3 | CCNc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL544678 | 77656 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -5 | 4 | ChEMBL | 298 | 3 | 2 | 9 | 1.3 | CCNc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 11560510 | 139012 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 406 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(C)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL378570 | 139012 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 406 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(C)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 44307827 | 203518 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 369 | 6 | 2 | 6 | 2.3 | CCCn1c(=O)c2nc(-c3ccc(NC(C)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL66337 | 203518 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 369 | 6 | 2 | 6 | 2.3 | CCCn1c(=O)c2nc(-c3ccc(NC(C)=O)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL5088622 | 215163 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -5 | 7 | ChEMBL | None | None | None | Nc1nc(-c2ccccc2)c2c(n1)-c1cc(OCCCN3CCCC3)ccc1C2 | 10.1021/acs.jmedchem.0c00914 | |||||
| 128525 | 154722 | None | 10 | Human | Binding | pKi | = | 6.4 | 6.4 | 5 | 6 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| CHEMBL39986 | 154722 | None | 10 | Human | Binding | pKi | = | 6.4 | 6.4 | 5 | 6 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| 11713241 | 78234 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 512 | 7 | 1 | 7 | 4.4 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)cc(Cl)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210614 | 78234 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 512 | 7 | 1 | 7 | 4.4 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(C(F)(F)F)cc(Cl)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 71681203 | 90206 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -10 | 5 | ChEMBL | 330 | 5 | 1 | 5 | 3.7 | O=C(CCCc1ccccc1)Nc1nc2sccc2c(=O)s1 | 10.1021/jm400336x | |||
| CHEMBL2382425 | 90206 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -10 | 5 | ChEMBL | 330 | 5 | 1 | 5 | 3.7 | O=C(CCCc1ccccc1)Nc1nc2sccc2c(=O)s1 | 10.1021/jm400336x | |||
| 71683091 | 89935 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -4 | 6 | ChEMBL | 310 | 4 | 1 | 4 | 3.2 | O=C(CCc1ccccc1)Nc1nc2ccccc2c(=O)s1 | 10.1021/jm400336x | |||
| CHEMBL2380385 | 89935 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -4 | 6 | ChEMBL | 310 | 4 | 1 | 4 | 3.2 | O=C(CCc1ccccc1)Nc1nc2ccccc2c(=O)s1 | 10.1021/jm400336x | |||
| 52945064 | 19089 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 2 | ChEMBL | 538 | 9 | 1 | 4 | 6.0 | Cn1c(=O)c(-c2ccc(F)cc2F)c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccccc3)ccc21 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289108 | 19089 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 2 | ChEMBL | 538 | 9 | 1 | 4 | 6.0 | Cn1c(=O)c(-c2ccc(F)cc2F)c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccccc3)ccc21 | 10.1016/j.bmcl.2010.10.030 | |||
| 21958639 | 64301 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(Cl)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181062 | 64301 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(Cl)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 11386951 | 66883 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -75 | 3 | ChEMBL | 527 | 9 | 5 | 16 | -0.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc([N+](=O)[O-])cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL186403 | 66883 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -75 | 3 | ChEMBL | 527 | 9 | 5 | 16 | -0.7 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc([N+](=O)[O-])cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 46880418 | 6337 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 281 | 4 | 1 | 4 | 2.7 | CC(=O)c1nc(NC(=O)C2CC2)ccc1-c1ccncc1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082004 | 6337 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 281 | 4 | 1 | 4 | 2.7 | CC(=O)c1nc(NC(=O)C2CC2)ccc1-c1ccncc1 | 10.1016/j.bmcl.2010.01.045 | |||
| 10379032 | 7519 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 4 | 4 | ChEMBL | 282 | 3 | 1 | 5 | 1.3 | C=CCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL10873 | 7519 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 4 | 4 | ChEMBL | 282 | 3 | 1 | 5 | 1.3 | C=CCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(C)c1=O | 10.1021/jm0104318 | |||
| 10961304 | 76010 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 4 | ChEMBL | 447 | 6 | 3 | 10 | 3.4 | CCNc1c2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL20555 | 76010 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 4 | ChEMBL | 447 | 6 | 3 | 10 | 3.4 | CCNc1c2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL554955 | 76010 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 4 | ChEMBL | 447 | 6 | 3 | 10 | 3.4 | CCNc1c2c(nc(NC(=O)Nc3ccc(OC)cc3)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 21958681 | 94559 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 40 | 4 | ChEMBL | 336 | 4 | 2 | 6 | 1.3 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251873 | 94559 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 40 | 4 | ChEMBL | 336 | 4 | 2 | 6 | 1.3 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 52944930 | 19292 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 2 | 3 | ChEMBL | 495 | 9 | 2 | 5 | 5.1 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290436 | 19292 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 2 | 3 | ChEMBL | 495 | 9 | 2 | 5 | 5.1 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)NCc1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11612320 | 77279 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4C(F)(F)F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL208110 | 77279 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4C(F)(F)F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11633189 | 78255 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 422 | 8 | 1 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(OC)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210683 | 78255 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 422 | 8 | 1 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(OC)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11582578 | 140137 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 422 | 8 | 1 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4OC)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL380219 | 140137 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 422 | 8 | 1 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4OC)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11656185 | 72594 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 494 | 9 | 2 | 6 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199327 | 72594 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 494 | 9 | 2 | 6 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 155531922 | 171728 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1016/j.ejmech.2021.113907 | |||
| CHEMBL4467152 | 171728 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1016/j.ejmech.2021.113907 | |||
| 155531922 | 171728 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4467152 | 171728 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 135949027 | 178607 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -9 | 3 | ChEMBL | 277 | 2 | 2 | 5 | 3.2 | N#Cc1c(-c2ccc(O)cc2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| CHEMBL467366 | 178607 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -9 | 3 | ChEMBL | 277 | 2 | 2 | 5 | 3.2 | N#Cc1c(-c2ccc(O)cc2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| 135433658 | 3205 | None | 3 | Human | Binding | pKi | = | 5.4 | 5.4 | -371 | 8 | ChEMBL | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 10.1016/j.ejmech.2019.111879 | |||
| 5620 | 3205 | None | 3 | Human | Binding | pKi | = | 5.4 | 5.4 | -371 | 8 | ChEMBL | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 10.1016/j.ejmech.2019.111879 | |||
| 9882625 | 3205 | None | 3 | Human | Binding | pKi | = | 5.4 | 5.4 | -371 | 8 | ChEMBL | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL1625681 | 3205 | None | 3 | Human | Binding | pKi | = | 5.4 | 5.4 | -371 | 8 | ChEMBL | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 10.1016/j.ejmech.2019.111879 | |||
| 135414399 | 78152 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 330 | 5 | 1 | 7 | 1.4 | CCCn1c(=O)c2nc(-c3cc(C)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210389 | 78152 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 330 | 5 | 1 | 7 | 1.4 | CCCn1c(=O)c2nc(-c3cc(C)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 17198003 | 138976 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3785353 | 138976 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 17198003 | 138976 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785353 | 138976 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 17198003 | 138976 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3785353 | 138976 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 353 | 3 | 1 | 6 | 4.3 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11553439 | 72683 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 5 | 2 | ChEMBL | 415 | 9 | 1 | 8 | 1.7 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3CCCOC)cc1 | 10.1021/jm0506221 | |||
| CHEMBL199664 | 72683 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 5 | 2 | ChEMBL | 415 | 9 | 1 | 8 | 1.7 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3CCCOC)cc1 | 10.1021/jm0506221 | |||
| 46233347 | 200295 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 1 | 3 | ChEMBL | 380 | 5 | 0 | 7 | 2.6 | CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccccc2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL597354 | 200295 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 1 | 3 | ChEMBL | 380 | 5 | 0 | 7 | 2.6 | CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccccc2)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL5088305 | 215149 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 1 | 4 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)cc(SCc2ncc[nH]2)nc1N | 10.1021/acs.jmedchem.0c01856 | |||||
| 10980845 | 137873 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 344 | 6 | 3 | 6 | 1.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37621 | 137873 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -2 | 2 | ChEMBL | 344 | 6 | 3 | 6 | 1.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 50940921 | 57231 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -2 | 4 | ChEMBL | 395 | 6 | 1 | 5 | 5.6 | CCC(=O)Nc1nc(-c2ccc(SC)cc2)cc(-c2ccc(SC)cc2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650152 | 57231 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -2 | 4 | ChEMBL | 395 | 6 | 1 | 5 | 5.6 | CCC(=O)Nc1nc(-c2ccc(SC)cc2)cc(-c2ccc(SC)cc2)n1 | 10.1021/jm100843z | |||
| 10475082 | 74 | None | 23 | Human | Binding | pKi | = | 4.4 | 4.4 | -1995 | 6 | ChEMBL | 383 | 4 | 4 | 9 | 0.8 | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm049408n | |||
| 5591 | 74 | None | 23 | Human | Binding | pKi | = | 4.4 | 4.4 | -1995 | 6 | ChEMBL | 383 | 4 | 4 | 9 | 0.8 | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm049408n | |||
| CHEMBL251997 | 74 | None | 23 | Human | Binding | pKi | = | 4.4 | 4.4 | -1995 | 6 | ChEMBL | 383 | 4 | 4 | 9 | 0.8 | OC[C@H]1O[C@H]([C@]([C@@H]1O)(C)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10.1021/jm049408n | |||
| 135546657 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL408186 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135546657 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL408186 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135546657 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL408186 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 44406607 | 72701 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 8 | 4 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccccc5Cl)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL199732 | 72701 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 8 | 4 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccccc5Cl)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 21958536 | 167562 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 300 | 4 | 2 | 6 | 0.7 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cn[nH]c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL430050 | 167562 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 3 | ChEMBL | 300 | 4 | 2 | 6 | 0.7 | CCn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cn[nH]c3)nc21 | 10.1021/jm7014815 | |||
| 135546657 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL408186 | 157696 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(NC(=O)Cc4ccc(OC)c(OC)c4)nn3C)nc2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11555329 | 73237 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 2 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccc(Br)cc1 | 10.1021/jm0506221 | |||
| CHEMBL201243 | 73237 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 2 | 2 | ChEMBL | 512 | 6 | 2 | 7 | 3.0 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)Nc1ccc(Br)cc1 | 10.1021/jm0506221 | |||
| 44451200 | 96128 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 3 | 2 | ChEMBL | 587 | 10 | 1 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)OCc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260433 | 96128 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 3 | 2 | ChEMBL | 587 | 10 | 1 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)OCc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 46227974 | 201250 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 5 | 3 | ChEMBL | 430 | 7 | 0 | 8 | 2.1 | COCCn1c(=O)c2c(nc(Cc3c(F)cccc3F)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL603861 | 201250 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 5 | 3 | ChEMBL | 430 | 7 | 0 | 8 | 2.1 | COCCn1c(=O)c2c(nc(Cc3c(F)cccc3F)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 46880331 | 6226 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 281 | 3 | 1 | 6 | 2.2 | CC(=O)Nc1ncc(-c2ccncn2)c(-c2ccco2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081458 | 6226 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 281 | 3 | 1 | 6 | 2.2 | CC(=O)Nc1ncc(-c2ccncn2)c(-c2ccco2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46880417 | 6336 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 273 | 3 | 1 | 3 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(Cl)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082003 | 6336 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 273 | 3 | 1 | 3 | 3.1 | O=C(Nc1ccc(-c2ccncc2)c(Cl)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 2817023 | 181354 | None | 6 | Human | Binding | pKi | = | 6.4 | 6.4 | -31 | 3 | ChEMBL | 267 | 2 | 1 | 5 | 3.5 | N#Cc1c(-c2ccco2)cc(-c2cccs2)nc1N | 10.1021/jm701594y | |||
| CHEMBL476310 | 181354 | None | 6 | Human | Binding | pKi | = | 6.4 | 6.4 | -31 | 3 | ChEMBL | 267 | 2 | 1 | 5 | 3.5 | N#Cc1c(-c2ccco2)cc(-c2cccs2)nc1N | 10.1021/jm701594y | |||
| 9880921 | 190180 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -57 | 4 | ChEMBL | 337 | 4 | 1 | 9 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3[N+](=O)[O-])c2n1 | 10.1021/jm800961g | |||
| CHEMBL517418 | 190180 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -57 | 4 | ChEMBL | 337 | 4 | 1 | 9 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3ccccc3[N+](=O)[O-])c2n1 | 10.1021/jm800961g | |||
| CHEMBL5083146 | 214844 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -69 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2cccc(Cl)c2)nc(N)nc1-c1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.1c01636 | |||||
| 72697649 | 104035 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -13 | 4 | ChEMBL | 413 | 2 | 0 | 7 | 1.8 | C#CCn1c(=O)c2c(nc3n2CCCN3c2cccc(Br)c2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3093331 | 104035 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -13 | 4 | ChEMBL | 413 | 2 | 0 | 7 | 1.8 | C#CCn1c(=O)c2c(nc3n2CCCN3c2cccc(Br)c2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 44410409 | 75970 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -1949 | 4 | ChEMBL | 496 | 7 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccccc4OC)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL205327 | 75970 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -1949 | 4 | ChEMBL | 496 | 7 | 5 | 11 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccccc4OC)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 156010696 | 177155 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -128 | 2 | ChEMBL | 340 | 3 | 1 | 7 | 3.3 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1nccs1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4634105 | 177155 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -128 | 2 | ChEMBL | 340 | 3 | 1 | 7 | 3.3 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1nccs1 | 10.1021/acs.jmedchem.0c00564 | |||
| 135443353 | 110592 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 11 | 2 | ChEMBL | 484 | 7 | 3 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4cccc(Cl)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32552 | 110592 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 11 | 2 | ChEMBL | 484 | 7 | 3 | 8 | 3.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4cccc(Cl)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10779327 | 119407 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -15 | 6 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL344706 | 119407 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -15 | 6 | ChEMBL | 283 | 3 | 1 | 8 | 1.7 | CCCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 16720105 | 85379 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 347 | 5 | 1 | 9 | 2.7 | COc1ncc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)cn1 | 10.1021/jm061333v | |||
| CHEMBL226236 | 85379 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 347 | 5 | 1 | 9 | 2.7 | COc1ncc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)cn1 | 10.1021/jm061333v | |||
| 11698898 | 140360 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 74 | 2 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL380821 | 140360 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 74 | 2 | ChEMBL | 494 | 8 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 655439 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL1544856 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.5b01586 | |||
| 655439 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL1544856 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.7b00138 | |||
| 655439 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1544856 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 655439 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/ml400185v | |||
| CHEMBL1544856 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/ml400185v | |||
| 655439 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL1544856 | 47394 | None | 16 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 126079 | 4098 | None | 31 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 8 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm0506221 | |||
| 451 | 4098 | None | 31 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 8 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm0506221 | |||
| CHEMBL27041 | 4098 | None | 31 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 8 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm0506221 | |||
| 11174953 | 16760 | None | 1 | Human | Binding | pKi | = | 7.4 | 7.4 | -3 | 4 | ChEMBL | 332 | 4 | 2 | 6 | 3.1 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccccc1 | 10.1021/acs.jmedchem.0c01856 | |||
| CHEMBL124345 | 16760 | None | 1 | Human | Binding | pKi | = | 7.4 | 7.4 | -3 | 4 | ChEMBL | 332 | 4 | 2 | 6 | 3.1 | N#Cc1c(N)nc(SCc2ncc[nH]2)c(C#N)c1-c1ccccc1 | 10.1021/acs.jmedchem.0c01856 | |||
| 53354632 | 74284 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 316 | 2 | 1 | 4 | 4.1 | Nc1nnc(-c2cc(Cl)cc(Cl)c2)c(-c2ccccc2)n1 | 10.1021/jm201376w | |||
| CHEMBL2024112 | 74284 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 316 | 2 | 1 | 4 | 4.1 | Nc1nnc(-c2cc(Cl)cc(Cl)c2)c(-c2ccccc2)n1 | 10.1021/jm201376w | |||
| 11560981 | 78309 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4c(F)cccc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210890 | 78309 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4c(F)cccc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 7315331 | 201127 | None | 1 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 4 | ChEMBL | 352 | 5 | 1 | 5 | 4.6 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1 | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL603129 | 201127 | None | 1 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 4 | ChEMBL | 352 | 5 | 1 | 5 | 4.6 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1 | 10.1016/j.bmc.2010.01.072 | |||
| 10085373 | 10426 | None | 6 | Human | Binding | pKi | = | 6.4 | 6.4 | -616 | 2 | ChEMBL | 286 | 2 | 1 | 6 | 0.6 | COc1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm0104318 | |||
| CHEMBL11635 | 10426 | None | 6 | Human | Binding | pKi | = | 6.4 | 6.4 | -616 | 2 | ChEMBL | 286 | 2 | 1 | 6 | 0.6 | COc1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 | 10.1021/jm0104318 | |||
| 21874613 | 176177 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -263 | 4 | ChEMBL | 349 | 4 | 2 | 8 | 2.8 | CC(C)c1cc(Cn2nnc3c(-c4ccco4)nc(N)nc32)ccc1N | 10.1021/jm800961g | |||
| CHEMBL459322 | 176177 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -263 | 4 | ChEMBL | 349 | 4 | 2 | 8 | 2.8 | CC(C)c1cc(Cn2nnc3c(-c4ccco4)nc(N)nc32)ccc1N | 10.1021/jm800961g | |||
| 72697931 | 103817 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -17 | 5 | ChEMBL | 313 | 2 | 0 | 7 | 0.3 | C#CCn1c(=O)c2c(nc3n2CCCN3C2CCC2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL3091482 | 103817 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -17 | 5 | ChEMBL | 313 | 2 | 0 | 7 | 0.3 | C#CCn1c(=O)c2c(nc3n2CCCN3C2CCC2)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 10190 | 934 | None | 45 | Human | Binding | pKi | = | 5.4 | 5.4 | -1174 | 4 | ChEMBL | 407 | 6 | 1 | 10 | 2.1 | Nc1nc(c2ccc(o2)C)c2c(n1)n(nn2)Cc1cccc(n1)CO[C@@H]1COCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| 44537963 | 934 | None | 45 | Human | Binding | pKi | = | 5.4 | 5.4 | -1174 | 4 | ChEMBL | 407 | 6 | 1 | 10 | 2.1 | Nc1nc(c2ccc(o2)C)c2c(n1)n(nn2)Cc1cccc(n1)CO[C@@H]1COCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL4297184 | 934 | None | 45 | Human | Binding | pKi | = | 5.4 | 5.4 | -1174 | 4 | ChEMBL | 407 | 6 | 1 | 10 | 2.1 | Nc1nc(c2ccc(o2)C)c2c(n1)n(nn2)Cc1cccc(n1)CO[C@@H]1COCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| DB16125 | 934 | None | 45 | Human | Binding | pKi | = | 5.4 | 5.4 | -1174 | 4 | ChEMBL | 407 | 6 | 1 | 10 | 2.1 | Nc1nc(c2ccc(o2)C)c2c(n1)n(nn2)Cc1cccc(n1)CO[C@@H]1COCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| 3281 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | ChEMBL | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| 9953065 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | ChEMBL | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL4204703 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | ChEMBL | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL592435 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | ChEMBL | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| DB12446 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | ChEMBL | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 10.1016/j.bmc.2010.01.072 | |||
| 57429645 | 157006 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 557 | 8 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3cnn(C(C)C4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4073346 | 157006 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 557 | 8 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3cnn(C(C)C4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 69031481 | 157075 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 81 | 3 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4074253 | 157075 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 81 | 3 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(F)(F)F)cc5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 69029798 | 158208 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 520 | 9 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(F)cc5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4088043 | 158208 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 520 | 9 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(F)cc5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 66893509 | 158498 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4091110 | 158498 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC(F)(F)F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 46880507 | 6152 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 8 | 3 | ChEMBL | 333 | 4 | 1 | 3 | 4.3 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccc(F)cc2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081038 | 6152 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 8 | 3 | ChEMBL | 333 | 4 | 1 | 3 | 4.3 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccc(F)cc2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46866592 | 6329 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 60 | 4 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncn2)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46866592 | 6329 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 60 | 4 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncn2)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1081971 | 6329 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 60 | 4 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncn2)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081971 | 6329 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 60 | 4 | ChEMBL | 306 | 4 | 1 | 5 | 3.1 | O=C(Nc1ccc(-c2ccncn2)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.077 | |||
| 56924646 | 71170 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 186 | 2 | ChEMBL | 332 | 5 | 2 | 7 | 0.4 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955922 | 71170 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 186 | 2 | ChEMBL | 332 | 5 | 2 | 7 | 0.4 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 49797905 | 10741 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | -1 | 3 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1171164 | 10741 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | -1 | 3 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 49797748 | 10618 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 25 | 3 | ChEMBL | 480 | 6 | 1 | 6 | 4.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCCCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170135 | 10618 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 25 | 3 | ChEMBL | 480 | 6 | 1 | 6 | 4.6 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCCCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797905 | 10741 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | -1 | 3 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171164 | 10741 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | -1 | 3 | ChEMBL | 517 | 7 | 1 | 7 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(C(F)(F)F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797773 | 10855 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 17 | 3 | ChEMBL | 490 | 8 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN(C)S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172277 | 10855 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 17 | 3 | ChEMBL | 490 | 8 | 1 | 7 | 3.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(CN(C)S(C)(=O)=O)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 11555462 | 73034 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 11 | 2 | ChEMBL | 522 | 10 | 2 | 6 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)NCc4ccc(Cl)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201028 | 73034 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 11 | 2 | ChEMBL | 522 | 10 | 2 | 6 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)NCc4ccc(Cl)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 136042340 | 71164 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 2 | ChEMBL | 527 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955916 | 71164 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 2 | ChEMBL | 527 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Br)ccc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 46229141 | 199129 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 23 | 2 | ChEMBL | 614 | 25 | 1 | 10 | 4.8 | C=CCCCCCCCCCCOCCOCCOCCOCCOc1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.bmc.2010.02.014 | |||
| CHEMBL589251 | 199129 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 23 | 2 | ChEMBL | 614 | 25 | 1 | 10 | 4.8 | C=CCCCCCCCCCCOCCOCCOCCOCCOc1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.bmc.2010.02.014 | |||
| 44451053 | 96102 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 41 | 2 | ChEMBL | 597 | 9 | 1 | 7 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260221 | 96102 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 41 | 2 | ChEMBL | 597 | 9 | 1 | 7 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44451285 | 161270 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 31 | 2 | ChEMBL | 541 | 5 | 1 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL412063 | 161270 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 31 | 2 | ChEMBL | 541 | 5 | 1 | 7 | 3.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C(F)(F)F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44451126 | 166883 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 134 | 2 | ChEMBL | 529 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL428604 | 166883 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 134 | 2 | ChEMBL | 529 | 7 | 1 | 7 | 3.6 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 11690712 | 77790 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 1 | 5 | ChEMBL | 439 | 7 | 3 | 6 | 2.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCc4ccccc4)cc3)nc2c1=O | 10.1021/jm060277v | |||
| CHEMBL209230 | 77790 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 1 | 5 | ChEMBL | 439 | 7 | 3 | 6 | 2.0 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)NCc4ccccc4)cc3)nc2c1=O | 10.1021/jm060277v | |||
| 44451123 | 95836 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 151 | 2 | ChEMBL | 570 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5c(Cl)cncc5Cl)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258948 | 95836 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 151 | 2 | ChEMBL | 570 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5c(Cl)cncc5Cl)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 155562182 | 175714 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 22 | 3 | ChEMBL | 510 | 6 | 3 | 8 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(O)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4582353 | 175714 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 22 | 3 | ChEMBL | 510 | 6 | 3 | 8 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(O)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155553575 | 174185 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 75 | 2 | ChEMBL | 556 | 7 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)nc2n(CC)c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4547661 | 174185 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 75 | 2 | ChEMBL | 556 | 7 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)nc2n(CC)c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 10970127 | 121070 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 4 | 4 | ChEMBL | 348 | 3 | 2 | 4 | 2.3 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL35701 | 121070 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 4 | 4 | ChEMBL | 348 | 3 | 2 | 4 | 2.3 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 11568359 | 78224 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 2 | 6 | ChEMBL | 439 | 6 | 2 | 7 | 1.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCCc4ccccc4)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| CHEMBL210585 | 78224 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | 2 | 6 | ChEMBL | 439 | 6 | 2 | 7 | 1.1 | Cn1c(=O)c2nc(-c3ccc(S(=O)(=O)NCCc4ccccc4)cc3)[nH]c2n(C)c1=O | 10.1021/jm060277v | |||
| 69030381 | 158839 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4094755 | 158839 | None | 0 | Human | Binding | pKi | = | 8.4 | 8.4 | - | 1 | ChEMBL | 529 | 7 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 69031242 | 155806 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 520 | 9 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(F)c5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4059759 | 155806 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 520 | 9 | 1 | 8 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(F)c5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11663068 | 72735 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 2 | ChEMBL | 484 | 9 | 2 | 6 | 4.0 | O=C(COc1ccc(-c2cc3c([nH]2)c(=O)n(CC2CC2)c(=O)n3CC2CC2)cc1)Nc1ccccc1 | 10.1021/jm0506221 | |||
| CHEMBL199862 | 72735 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 2 | ChEMBL | 484 | 9 | 2 | 6 | 4.0 | O=C(COc1ccc(-c2cc3c([nH]2)c(=O)n(CC2CC2)c(=O)n3CC2CC2)cc1)Nc1ccccc1 | 10.1021/jm0506221 | |||
| 44450849 | 161303 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 33 | 2 | ChEMBL | 514 | 8 | 1 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)N4CCc5ccccc5C4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL412293 | 161303 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 33 | 2 | ChEMBL | 514 | 8 | 1 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)N4CCc5ccccc5C4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 15627855 | 98305 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 9 | 3 | ChEMBL | 270 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL274855 | 98305 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 9 | 3 | ChEMBL | 270 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm0310030 | |||
| 15627855 | 98305 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 9 | 3 | ChEMBL | 270 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL274855 | 98305 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 9 | 3 | ChEMBL | 270 | 3 | 2 | 4 | 1.5 | CCCn1c(=O)[nH]c2[nH]c(-c3ccccc3)nc2c1=O | 10.1021/jm011049y | |||
| 11553509 | 72670 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 1 | 4 | ChEMBL | 418 | 5 | 2 | 6 | 2.6 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccccc1 | 10.1021/jm0506221 | |||
| CHEMBL199611 | 72670 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 1 | 4 | ChEMBL | 418 | 5 | 2 | 6 | 2.6 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)Nc1ccccc1 | 10.1021/jm0506221 | |||
| 11649117 | 140546 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 2 | ChEMBL | 506 | 10 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(CC)C(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL381091 | 140546 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 2 | ChEMBL | 506 | 10 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(CC)C(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451021 | 95864 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 33 | 2 | ChEMBL | 529 | 9 | 1 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259057 | 95864 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 33 | 2 | ChEMBL | 529 | 9 | 1 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11590537 | 75003 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 4 | 2 | ChEMBL | 452 | 6 | 2 | 6 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(Cl)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203305 | 75003 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 4 | 2 | ChEMBL | 452 | 6 | 2 | 6 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccc(Cl)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451099 | 96292 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 81 | 2 | ChEMBL | 561 | 11 | 1 | 9 | 2.2 | COCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCOC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL261212 | 96292 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 81 | 2 | ChEMBL | 561 | 11 | 1 | 9 | 2.2 | COCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCOC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 57429603 | 157379 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 484 | 6 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4078183 | 157379 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 484 | 6 | 1 | 7 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(F)(F)F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 76314450 | 105511 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -12 | 4 | ChEMBL | 343 | 5 | 1 | 7 | 0.6 | CN(C)CCOc1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.ejmech.2014.01.045 | |||
| CHEMBL3121720 | 105511 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -12 | 4 | ChEMBL | 343 | 5 | 1 | 7 | 0.6 | CN(C)CCOc1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.ejmech.2014.01.045 | |||
| 126079 | 4098 | None | 31 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 8 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm0104318 | |||
| 451 | 4098 | None | 31 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 8 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm0104318 | |||
| CHEMBL27041 | 4098 | None | 31 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 8 | ChEMBL | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 10.1021/jm0104318 | |||
| 10863425 | 56736 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 2 | 4 | ChEMBL | 456 | 4 | 2 | 8 | 4.7 | CCn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164275 | 56736 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 2 | 4 | ChEMBL | 456 | 4 | 2 | 8 | 4.7 | CCn1cc2c(nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 135874430 | 160128 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 517 | 8 | 2 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)c(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL410895 | 160128 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 517 | 8 | 2 | 8 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)c(Cl)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 11596614 | 77097 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 3 | ChEMBL | 406 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(C)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL207524 | 77097 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 3 | ChEMBL | 406 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(C)cc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL5094532 | 215499 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(N)nc1-c1cccs1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 163215620 | 190341 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -398 | 4 | ChEMBL | 318 | 3 | 2 | 6 | 1.8 | Nc1nc(C(=O)NCc2ccccn2)cn2c1nc1ccccc12 | 10.1021/acs.jmedchem.2c00101 | |||
| CHEMBL5176737 | 190341 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -398 | 4 | ChEMBL | 318 | 3 | 2 | 6 | 1.8 | Nc1nc(C(=O)NCc2ccccn2)cn2c1nc1ccccc12 | 10.1021/acs.jmedchem.2c00101 | |||
| CHEMBL5203105 | 190341 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -398 | 4 | ChEMBL | 318 | 3 | 2 | 6 | 1.8 | Nc1nc(C(=O)NCc2ccccn2)cn2c1nc1ccccc12 | 10.1021/acs.jmedchem.2c00101 | |||
| 49798161 | 10753 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 4 | 3 | ChEMBL | 537 | 6 | 1 | 9 | 3.6 | COc1cc(OCc2nc(-c3ccc(Br)cc3)no2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1171379 | 10753 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 4 | 3 | ChEMBL | 537 | 6 | 1 | 9 | 3.6 | COc1cc(OCc2nc(-c3ccc(Br)cc3)no2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.ejmech.2010.03.011 | |||
| 2748294 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL1490082 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 2748294 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL1490082 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 2748294 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1490082 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 2748294 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/ml400185v | |||
| CHEMBL1490082 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/ml400185v | |||
| 2748294 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL1490082 | 41375 | None | 21 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 264 | 3 | 2 | 4 | 1.9 | CC1=C(C(=O)OC(C)C)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 10661707 | 161837 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -8 | 4 | ChEMBL | 297 | 1 | 1 | 8 | 2.1 | CC(C)(C)n1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL414620 | 161837 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -8 | 4 | ChEMBL | 297 | 1 | 1 | 8 | 2.1 | CC(C)(C)n1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 11162618 | 195500 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -154 | 4 | ChEMBL | 308 | 4 | 2 | 5 | 2.6 | Cc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)c1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL553449 | 195500 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -154 | 4 | ChEMBL | 308 | 4 | 2 | 5 | 2.6 | Cc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)c1 | 10.1016/j.bmcl.2009.03.142 | |||
| 156010620 | 177033 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -79 | 2 | ChEMBL | 323 | 3 | 2 | 6 | 2.6 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncc[nH]1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4632427 | 177033 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -79 | 2 | ChEMBL | 323 | 3 | 2 | 6 | 2.6 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncc[nH]1 | 10.1021/acs.jmedchem.0c00564 | |||
| 162665941 | 182376 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 292 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC2CCC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4785137 | 182376 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 292 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC2CCC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 14969717 | 203755 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 18 | 3 | ChEMBL | 256 | 3 | 2 | 4 | 0.7 | O=c1[nH]c2[nH]cnc2c(=O)n1CCc1ccccc1 | 10.1021/jm0104318 | |||
| CHEMBL67949 | 203755 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | 18 | 3 | ChEMBL | 256 | 3 | 2 | 4 | 0.7 | O=c1[nH]c2[nH]cnc2c(=O)n1CCc1ccccc1 | 10.1021/jm0104318 | |||
| 71681051 | 90203 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -4 | 5 | ChEMBL | 338 | 5 | 1 | 4 | 3.9 | Cc1ccc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1 | 10.1021/jm400336x | |||
| CHEMBL2382420 | 90203 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -4 | 5 | ChEMBL | 338 | 5 | 1 | 4 | 3.9 | Cc1ccc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1 | 10.1021/jm400336x | |||
| 135440168 | 99953 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 23 | 2 | ChEMBL | 466 | 9 | 2 | 10 | 1.5 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccncc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286420 | 99953 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 23 | 2 | ChEMBL | 466 | 9 | 2 | 10 | 1.5 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccncc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 66894243 | 158585 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 8 | 1 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4092017 | 158585 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 8 | 1 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 46880373 | 5935 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -3 | 4 | ChEMBL | 253 | 3 | 1 | 4 | 2.6 | N#Cc1ccc(NC(=O)C2CC2)nc1-c1ccco1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1079801 | 5935 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -3 | 4 | ChEMBL | 253 | 3 | 1 | 4 | 2.6 | N#Cc1ccc(NC(=O)C2CC2)nc1-c1ccco1 | 10.1016/j.bmcl.2010.01.045 | |||
| 11656109 | 78378 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 490 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(OC)c(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL211038 | 78378 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 490 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(OC)c(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 9893136 | 98757 | None | 0 | Human | Binding | pKi | = | 4.4 | 4.4 | -19498 | 6 | ChEMBL | 527 | 5 | 4 | 8 | 2.0 | OC[C@@]12C[C@@H]1[C@@H](n1cnc3c(NCc4cccc(I)c4)nc(Cl)nc31)[C@H](O)[C@@H]2O | 10.1021/jm9905965 | |||
| CHEMBL27809 | 98757 | None | 0 | Human | Binding | pKi | = | 4.4 | 4.4 | -19498 | 6 | ChEMBL | 527 | 5 | 4 | 8 | 2.0 | OC[C@@]12C[C@@H]1[C@@H](n1cnc3c(NCc4cccc(I)c4)nc(Cl)nc31)[C@H](O)[C@@H]2O | 10.1021/jm9905965 | |||
| 99562 | 99299 | None | 61 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 4 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL282038 | 99299 | None | 61 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 4 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| 99562 | 99299 | None | 61 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 4 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL282038 | 99299 | None | 61 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 4 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 99562 | 99299 | None | 61 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 4 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL282038 | 99299 | None | 61 | Human | Binding | pKi | = | 5.4 | 5.4 | 1 | 4 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1016/j.bmc.2013.09.044 | |||
| 1922 | 202816 | None | 44 | Human | Binding | pKi | = | 6.4 | 6.4 | -26 | 6 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL62350 | 202816 | None | 44 | Human | Binding | pKi | = | 6.4 | 6.4 | -26 | 6 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 1922 | 202816 | None | 44 | Human | Binding | pKi | = | 6.4 | 6.4 | -26 | 6 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm0310030 | |||
| CHEMBL62350 | 202816 | None | 44 | Human | Binding | pKi | = | 6.4 | 6.4 | -26 | 6 | ChEMBL | 256 | 1 | 1 | 5 | 0.6 | Cn1c(=O)c2nc(-c3ccccc3)[nH]c2n(C)c1=O | 10.1021/jm0310030 | |||
| 47104774 | 103847 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 296 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=S)N1 | 10.1021/ml400185v | |||
| CHEMBL3091705 | 103847 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 296 | 3 | 2 | 4 | 2.5 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=S)N1 | 10.1021/ml400185v | |||
| 21958526 | 130706 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -6 | 3 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(Cl)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL368442 | 130706 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -6 | 3 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(Cl)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 46880420 | 6339 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 7 | 3 | ChEMBL | 322 | 4 | 1 | 5 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2nccs2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082006 | 6339 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 7 | 3 | ChEMBL | 322 | 4 | 1 | 5 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2nccs2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 90654601 | 110032 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -4 | 2 | ChEMBL | 369 | 4 | 1 | 9 | 3.1 | N#Cc1c(N)nc(SCc2cscn2)nc1-c1ccc2c(c1)OCO2 | 10.1021/jm401643m | |||
| CHEMBL3234965 | 110032 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -4 | 2 | ChEMBL | 369 | 4 | 1 | 9 | 3.1 | N#Cc1c(N)nc(SCc2cscn2)nc1-c1ccc2c(c1)OCO2 | 10.1021/jm401643m | |||
| 44406617 | 72634 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 22 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(C(F)(F)F)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL199471 | 72634 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 22 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(C(F)(F)F)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11420226 | 96348 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 4 | 3 | ChEMBL | 479 | 7 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccc(Cl)cc5)on4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL261554 | 96348 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 4 | 3 | ChEMBL | 479 | 7 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(Cc4cc(-c5ccc(Cl)cc5)on4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 24828056 | 156506 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 9 | 3 | ChEMBL | 288 | 3 | 2 | 6 | 0.5 | CC(C)Cn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL406775 | 156506 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 9 | 3 | ChEMBL | 288 | 3 | 2 | 6 | 0.5 | CC(C)Cn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 9970296 | 120467 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 5 | ChEMBL | 269 | 3 | 2 | 3 | 2.1 | CCCn1c(=O)[nH]c2cc(-c3ccccc3)[nH]c2c1=O | 10.1021/jm011049y | |||
| CHEMBL35415 | 120467 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 5 | ChEMBL | 269 | 3 | 2 | 3 | 2.1 | CCCn1c(=O)[nH]c2cc(-c3ccccc3)[nH]c2c1=O | 10.1021/jm011049y | |||
| 155555919 | 174422 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4552910 | 174422 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11278089 | 84707 | None | 5 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 4 | ChEMBL | 303 | 4 | 1 | 3 | 4.2 | CCC(=O)Nc1nc(-c2ccccc2)cc(-c2ccccc2)n1 | 10.1021/jm100843z | |||
| CHEMBL222718 | 84707 | None | 5 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 4 | ChEMBL | 303 | 4 | 1 | 3 | 4.2 | CCC(=O)Nc1nc(-c2ccccc2)cc(-c2ccccc2)n1 | 10.1021/jm100843z | |||
| 11568517 | 74494 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 20 | 2 | ChEMBL | 446 | 7 | 1 | 6 | 2.7 | CCN(Cc1ccccc1)C(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1021/jm0506221 | |||
| CHEMBL202876 | 74494 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 20 | 2 | ChEMBL | 446 | 7 | 1 | 6 | 2.7 | CCN(Cc1ccccc1)C(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1021/jm0506221 | |||
| 44574281 | 178534 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 547 | 8 | 1 | 7 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL466828 | 178534 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 547 | 8 | 1 | 7 | 4.6 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 14969715 | 203792 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | -91 | 5 | ChEMBL | 208 | 3 | 2 | 4 | 0.2 | CCCCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| CHEMBL68278 | 203792 | None | 2 | Human | Binding | pKi | = | 6.4 | 6.4 | -91 | 5 | ChEMBL | 208 | 3 | 2 | 4 | 0.2 | CCCCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| 9858577 | 178670 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -13 | 4 | ChEMBL | 327 | 3 | 1 | 8 | 2.1 | Nc1nc(-c2cncs2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL467867 | 178670 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -13 | 4 | ChEMBL | 327 | 3 | 1 | 8 | 2.1 | Nc1nc(-c2cncs2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 76331767 | 103845 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091702 | 103845 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 76331767 | 103845 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccoc1 | 10.1021/ml400185v | |||
| CHEMBL3091702 | 103845 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccoc1 | 10.1021/ml400185v | |||
| 162672711 | 183227 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 276 | 4 | 2 | 4 | 1.9 | CC1=C(C(=O)OCC2CC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4796169 | 183227 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 276 | 4 | 2 | 4 | 1.9 | CC1=C(C(=O)OCC2CC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 44452514 | 95818 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 3 | ChEMBL | 323 | 6 | 1 | 7 | 3.0 | COCCCNc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL258848 | 95818 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 3 | ChEMBL | 323 | 6 | 1 | 7 | 3.0 | COCCCNc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 10834513 | 38796 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -12 | 4 | ChEMBL | 395 | 4 | 1 | 8 | 3.7 | Nc1nc2nn(CCc3cccc4ccccc34)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL146658 | 38796 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -12 | 4 | ChEMBL | 395 | 4 | 1 | 8 | 3.7 | Nc1nc2nn(CCc3cccc4ccccc34)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 11420910 | 96937 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -9 | 4 | ChEMBL | 513 | 9 | 1 | 10 | 3.0 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)Oc4cccc([N+](=O)[O-])c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| CHEMBL266099 | 96937 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -9 | 4 | ChEMBL | 513 | 9 | 1 | 10 | 3.0 | CCCn1c(=O)c2nc(-c3ccc(S(=O)(=O)Oc4cccc([N+](=O)[O-])c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0310030 | |||
| 66894271 | 157458 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 8 | 1 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(F)c5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4079189 | 157458 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 493 | 8 | 1 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(F)c5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 53325341 | 58021 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 14 | 2 | ChEMBL | 307 | 4 | 1 | 6 | 2.5 | O=C(Nc1cnc(-c2ccncc2)c(-c2cnco2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672625 | 58021 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 14 | 2 | ChEMBL | 307 | 4 | 1 | 6 | 2.5 | O=C(Nc1cnc(-c2ccncc2)c(-c2cnco2)n1)C1CC1 | 10.1021/ml100249e | |||
| 21874661 | 190471 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -60 | 4 | ChEMBL | 325 | 3 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(F)c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL517886 | 190471 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -60 | 4 | ChEMBL | 325 | 3 | 2 | 8 | 1.8 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(F)c3)c2n1 | 10.1021/jm800961g | |||
| 76324530 | 103843 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.6 | CCOC(=O)C1=C(C)NC(=S)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091700 | 103843 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.6 | CCOC(=O)C1=C(C)NC(=S)NC1c1ccoc1 | 10.1021/acs.jmedchem.0c01431 | |||
| 76324530 | 103843 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.6 | CCOC(=O)C1=C(C)NC(=S)NC1c1ccoc1 | 10.1021/ml400185v | |||
| CHEMBL3091700 | 103843 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 266 | 3 | 2 | 4 | 1.6 | CCOC(=O)C1=C(C)NC(=S)NC1c1ccoc1 | 10.1021/ml400185v | |||
| 44451790 | 95986 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -24 | 3 | ChEMBL | 316 | 2 | 1 | 6 | 3.0 | N#Cc1c(-c2ccccc2)nc(N)nc1-c1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.1c01636 | |||
| CHEMBL259607 | 95986 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -24 | 3 | ChEMBL | 316 | 2 | 1 | 6 | 3.0 | N#Cc1c(-c2ccccc2)nc(N)nc1-c1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.1c01636 | |||
| 156019165 | 177994 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2cocn2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4646279 | 177994 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2cocn2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL5082650 | 214813 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -10 | 7 | ChEMBL | None | None | None | Nc1nc(-c2ccccc2)c2c(n1)-c1cc(OCCCN3CCCCC3)ccc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||||
| 11595592 | 72308 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 93 | 2 | ChEMBL | 357 | 6 | 2 | 6 | 1.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL198345 | 72308 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 93 | 2 | ChEMBL | 357 | 6 | 2 | 6 | 1.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11611016 | 72693 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 22 | 2 | ChEMBL | 399 | 8 | 2 | 6 | 2.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199697 | 72693 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 22 | 2 | ChEMBL | 399 | 8 | 2 | 6 | 2.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)O)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451224 | 159386 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 6 | 3 | ChEMBL | 474 | 5 | 1 | 7 | 2.2 | COc1cc(OCC(=O)N2CCc3ccccc3C2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL410066 | 159386 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 6 | 3 | ChEMBL | 474 | 5 | 1 | 7 | 2.2 | COc1cc(OCC(=O)N2CCc3ccccc3C2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| 11143352 | 200147 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 3 | ChEMBL | 378 | 6 | 0 | 7 | 2.5 | CCCn1c(=O)c2c(nc(Cc3ccccc3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL596346 | 200147 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -1 | 3 | ChEMBL | 378 | 6 | 0 | 7 | 2.5 | CCCn1c(=O)c2c(nc(Cc3ccccc3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 9950776 | 83195 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -707 | 4 | ChEMBL | 360 | 5 | 2 | 6 | 2.0 | CCCn1c(=O)c2nc(C34CCC(O)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm060539t | |||
| CHEMBL218458 | 83195 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -707 | 4 | ChEMBL | 360 | 5 | 2 | 6 | 2.0 | CCCn1c(=O)c2nc(C34CCC(O)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm060539t | |||
| 21958522 | 64693 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5C)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181873 | 64693 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5C)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 44588439 | 175553 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 327 | 5 | 2 | 5 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(O)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457881 | 175553 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 327 | 5 | 2 | 5 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(O)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11611580 | 78233 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 8 | 3 | ChEMBL | 424 | 7 | 1 | 7 | 3.1 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(C)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210609 | 78233 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 8 | 3 | ChEMBL | 424 | 7 | 1 | 7 | 3.1 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(C)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.4 | 7.4 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm4011669 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.4 | 7.4 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm4011669 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.4 | 7.4 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm4011669 | |||
| 11663050 | 141088 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3cccc(OCC(=O)Nc4ccc(Br)cc4)c3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL382663 | 141088 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 1 | 2 | ChEMBL | 482 | 5 | 2 | 6 | 3.0 | Cn1c(=O)c2[nH]c(-c3cccc(OCC(=O)Nc4ccc(Br)cc4)c3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 24950846 | 170510 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -28 | 3 | ChEMBL | 265 | 2 | 1 | 5 | 3.4 | Cc1ccc(-c2cc(-c3ccco3)nc(N)c2C#N)o1 | 10.1021/jm701594y | |||
| CHEMBL444953 | 170510 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -28 | 3 | ChEMBL | 265 | 2 | 1 | 5 | 3.4 | Cc1ccc(-c2cc(-c3ccco3)nc(N)c2C#N)o1 | 10.1021/jm701594y | |||
| 21874692 | 188803 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -15 | 4 | ChEMBL | 337 | 4 | 1 | 9 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc([N+](=O)[O-])cc3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL505977 | 188803 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -15 | 4 | ChEMBL | 337 | 4 | 1 | 9 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc([N+](=O)[O-])cc3)c2n1 | 10.1021/jm800961g | |||
| 142609112 | 182138 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -131 | 4 | ChEMBL | 309 | 4 | 2 | 6 | 2.0 | Cc1cccnc1CNC(=O)c1cnc(-c2ccco2)nc1N | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL4782266 | 182138 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -131 | 4 | ChEMBL | 309 | 4 | 2 | 6 | 2.0 | Cc1cccnc1CNC(=O)c1cnc(-c2ccco2)nc1N | 10.1021/acs.jmedchem.0c00237 | |||
| 21874764 | 189209 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -3 | 4 | ChEMBL | 349 | 4 | 2 | 8 | 2.1 | CC(=O)Nc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| CHEMBL511413 | 189209 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -3 | 4 | ChEMBL | 349 | 4 | 2 | 8 | 2.1 | CC(=O)Nc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| 11808022 | 183561 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 278 | 2 | 2 | 4 | 2.2 | CC1=C(C(=O)OC(C)(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4800327 | 183561 | None | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | - | 1 | ChEMBL | 278 | 2 | 2 | 4 | 2.2 | CC1=C(C(=O)OC(C)(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 11289861 | 195289 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -63 | 4 | ChEMBL | 310 | 4 | 3 | 7 | 1.2 | Nc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL551373 | 195289 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -63 | 4 | ChEMBL | 310 | 4 | 3 | 7 | 1.2 | Nc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 4314924 | 177815 | None | 4 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 322 | 3 | 2 | 5 | 3.2 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]c1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4643705 | 177815 | None | 4 | Human | Binding | pKi | = | 6.4 | 6.4 | - | 1 | ChEMBL | 322 | 3 | 2 | 5 | 3.2 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]c1 | 10.1021/acs.jmedchem.0c00564 | |||
| 11091600 | 83318 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 449 | 6 | 1 | 10 | 3.2 | COc1ccc(CC(=O)Nc2nc3nn(C)c(SC)c3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm021023m | |||
| CHEMBL21910 | 83318 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -2 | 3 | ChEMBL | 449 | 6 | 1 | 10 | 3.2 | COc1ccc(CC(=O)Nc2nc3nn(C)c(SC)c3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm021023m | |||
| 24827552 | 96227 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 6 | 4 | ChEMBL | 379 | 5 | 1 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccc(C)nc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL260878 | 96227 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | 6 | 4 | ChEMBL | 379 | 5 | 1 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccc(C)nc4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL5088876 | 215182 | None | 0 | Human | Binding | pKi | = | 7.4 | 7.4 | -25 | 3 | ChEMBL | None | None | None | COc1cc(OC)cc(-c2nc(N)nc(-c3ccccc3)c2C#N)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 11508721 | 72264 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 16 | 2 | ChEMBL | 357 | 6 | 2 | 6 | 1.6 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc21 | 10.1021/jm0506221 | |||
| CHEMBL198243 | 72264 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 16 | 2 | ChEMBL | 357 | 6 | 2 | 6 | 1.6 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc21 | 10.1021/jm0506221 | |||
| 9890003 | 119409 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 4 | ChEMBL | 450 | 3 | 2 | 8 | 4.8 | CC(C)(C)n1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL344724 | 119409 | None | 0 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 4 | ChEMBL | 450 | 3 | 2 | 8 | 4.8 | CC(C)(C)n1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 145981689 | 166580 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -3 | 3 | ChEMBL | 579 | 14 | 1 | 10 | 2.6 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN3CCCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4280069 | 166580 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -3 | 3 | ChEMBL | 579 | 14 | 1 | 10 | 2.6 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN3CCCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 44390551 | 168337 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 511 | 9 | 1 | 10 | 3.9 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(C#N)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL434334 | 168337 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 511 | 9 | 1 | 10 | 3.9 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(C#N)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 2882256 | 31906 | None | 12 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 342 | 4 | 1 | 4 | 3.5 | CC1=C(C(=O)OCc2ccccc2)C(c2ccsc2)NC(=O)N1C | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1407320 | 31906 | None | 12 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 342 | 4 | 1 | 4 | 3.5 | CC1=C(C(=O)OCc2ccccc2)C(c2ccsc2)NC(=O)N1C | 10.1021/acs.jmedchem.0c01431 | |||
| 12267228 | 176934 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -3 | 2 | ChEMBL | 269 | 1 | 1 | 4 | 1.5 | Cc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL462095 | 176934 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -3 | 2 | ChEMBL | 269 | 1 | 1 | 4 | 1.5 | Cc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1016/j.bmc.2008.09.067 | |||
| 10938608 | 120109 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 416 | 5 | 2 | 8 | 4.1 | CCCn1cc2c(nc(NC(=O)Nc3ccc(C)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL351075 | 120109 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 416 | 5 | 2 | 8 | 4.1 | CCCn1cc2c(nc(NC(=O)Nc3ccc(C)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 24827443 | 96341 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 8 | 3 | ChEMBL | 365 | 5 | 1 | 8 | 1.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccccn4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL261525 | 96341 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 8 | 3 | ChEMBL | 365 | 5 | 1 | 8 | 1.6 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccccn4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 21874686 | 176817 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -30 | 4 | ChEMBL | 307 | 3 | 2 | 8 | 1.7 | Nc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| CHEMBL460975 | 176817 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -30 | 4 | ChEMBL | 307 | 3 | 2 | 8 | 1.7 | Nc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| 136044105 | 120049 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -1 | 3 | ChEMBL | 358 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OC)cc3O)nc2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL350469 | 120049 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -1 | 3 | ChEMBL | 358 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OC)cc3O)nc2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 46228004 | 200055 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 426 | 6 | 0 | 7 | 2.8 | Cn1c(Cc2c(F)cccc2F)nc2c1c(=O)n(CC1CC1)c(=O)n2Cc1ccco1 | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL595657 | 200055 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 426 | 6 | 0 | 7 | 2.8 | Cn1c(Cc2c(F)cccc2F)nc2c1c(=O)n(CC1CC1)c(=O)n2Cc1ccco1 | 10.1016/j.bmc.2009.07.034 | |||
| 11739282 | 196656 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -269 | 4 | ChEMBL | 339 | 6 | 2 | 7 | 1.8 | COCc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL564473 | 196656 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -269 | 4 | ChEMBL | 339 | 6 | 2 | 7 | 1.8 | COCc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 11739282 | 196656 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -269 | 4 | ChEMBL | 339 | 6 | 2 | 7 | 1.8 | COCc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)n1 | 10.1021/jm4011669 | |||
| CHEMBL564473 | 196656 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -269 | 4 | ChEMBL | 339 | 6 | 2 | 7 | 1.8 | COCc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)n1 | 10.1021/jm4011669 | |||
| 14969716 | 203589 | None | 2 | Human | Binding | pKi | = | 6.3 | 6.3 | 32 | 3 | ChEMBL | 192 | 2 | 2 | 4 | -0.4 | C=CCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| CHEMBL66899 | 203589 | None | 2 | Human | Binding | pKi | = | 6.3 | 6.3 | 32 | 3 | ChEMBL | 192 | 2 | 2 | 4 | -0.4 | C=CCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| 137650340 | 157518 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 290 | 3 | 2 | 5 | 1.7 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1ccsc1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4079899 | 157518 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 290 | 3 | 2 | 5 | 1.7 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1ccsc1 | 10.1021/acs.jmedchem.7b00138 | |||
| 49870828 | 18790 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -54 | 3 | ChEMBL | 373 | 3 | 0 | 7 | 3.5 | Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(-c4ccsc4)cc3c12 | 10.1016/j.bmc.2010.09.043 | |||
| CHEMBL1278102 | 18790 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -54 | 3 | ChEMBL | 373 | 3 | 0 | 7 | 3.5 | Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(-c4ccsc4)cc3c12 | 10.1016/j.bmc.2010.09.043 | |||
| 135465785 | 488 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 439 | 488 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL32582 | 488 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 135465785 | 488 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 439 | 488 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL32582 | 488 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 46880508 | 6153 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 18 | 3 | ChEMBL | 316 | 4 | 1 | 4 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccccn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081039 | 6153 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 18 | 3 | ChEMBL | 316 | 4 | 1 | 4 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2ccccn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46880332 | 6227 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 1 | 5 | 2.8 | CC(=O)Nc1ccc(-c2ccncn2)c(-c2ccco2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081459 | 6227 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 1 | 5 | 2.8 | CC(=O)Nc1ccc(-c2ccncn2)c(-c2ccco2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL5082920 | 214830 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -7 | 5 | ChEMBL | None | None | None | Nc1nc(-c2ccccc2)c2c(n1)-c1cc(OCCCN3CCCC3)ccc1C2=O | 10.1021/acs.jmedchem.0c00914 | |||||
| CHEMBL5083244 | 214852 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | None | None | None | CNc1nc(-c2ccccc2)c(C#N)c(-c2ccccc2F)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 1676 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL279898 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1016/j.ejmech.2016.11.007 | |||
| 1676 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL279898 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 1676 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL279898 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/acs.jmedchem.5b01586 | |||
| 1676 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/jm051268+ | |||
| CHEMBL279898 | 98982 | None | 61 | Human | Binding | pKi | = | 5.3 | 5.3 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/jm051268+ | |||
| 65269 | 188225 | None | 36 | Human | Binding | pKi | = | 4.3 | 4.3 | -21 | 4 | ChEMBL | 265 | 2 | 4 | 8 | -1.3 | Nc1ncnc2c1ncn2[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm9905965 | |||
| CHEMBL49935 | 188225 | None | 36 | Human | Binding | pKi | = | 4.3 | 4.3 | -21 | 4 | ChEMBL | 265 | 2 | 4 | 8 | -1.3 | Nc1ncnc2c1ncn2[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O | 10.1021/jm9905965 | |||
| CHEMBL5091545 | 215311 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -16 | 2 | ChEMBL | None | None | None | CNc1nc(-c2ccccc2)c(C#N)c(-c2ccc(C)cc2)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 44451105 | 160631 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 537 | 6 | 1 | 8 | 2.6 | COc1cc(OCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL411314 | 160631 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 537 | 6 | 1 | 8 | 2.6 | COc1cc(OCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| 46233214 | 200275 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -3 | 3 | ChEMBL | 344 | 6 | 1 | 6 | 2.3 | CCSCCn1c(=O)n(CC)c(=O)c2[nH]c(-c3ccccc3)nc21 | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL597169 | 200275 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -3 | 3 | ChEMBL | 344 | 6 | 1 | 6 | 2.3 | CCSCCn1c(=O)n(CC)c(=O)c2[nH]c(-c3ccccc3)nc21 | 10.1016/j.bmc.2010.01.028 | |||
| 44588473 | 175242 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 1 | 2 | ChEMBL | 357 | 6 | 1 | 7 | 2.7 | CCCn1c(=O)c2c(cc(-c3ccc(OC)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457209 | 175242 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 1 | 2 | ChEMBL | 357 | 6 | 1 | 7 | 2.7 | CCCn1c(=O)c2c(cc(-c3ccc(OC)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.3 | 7.3 | -154 | 11 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm011049y | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.3 | 7.3 | -154 | 11 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm011049y | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.3 | 7.3 | -154 | 11 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm011049y | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.3 | 7.3 | -154 | 11 | ChEMBL | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10.1021/jm011049y | |||
| 57429621 | 159172 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 418 | 5 | 3 | 7 | 1.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4098369 | 159172 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 418 | 5 | 3 | 7 | 1.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)[nH]c2c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 22266756 | 94593 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 464 | 6 | 2 | 9 | 2.4 | O=c1[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252074 | 94593 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 464 | 6 | 2 | 9 | 2.4 | O=c1[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| 11112849 | 57302 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -177 | 4 | ChEMBL | 432 | 4 | 2 | 10 | 3.1 | CCn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL165083 | 57302 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -177 | 4 | ChEMBL | 432 | 4 | 2 | 10 | 3.1 | CCn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 135874421 | 168956 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 477 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)c(C)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL438938 | 168956 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 477 | 8 | 2 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)c(C)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 11466670 | 72917 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 25 | 4 | ChEMBL | 527 | 8 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccc(C(F)(F)F)cc5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200451 | 72917 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 25 | 4 | ChEMBL | 527 | 8 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccc(C(F)(F)F)cc5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 52946584 | 201824 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 496 | 7 | 3 | 6 | 3.5 | CCCC1C(=O)Nc2nc(-c3ccc(OCC(=O)NC4CC(C)(C)N([O])C(C)(C)C4)cc3)[nH]c2C1=O | 10.1021/jm049513x | |||
| CHEMBL607025 | 201824 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 496 | 7 | 3 | 6 | 3.5 | CCCC1C(=O)Nc2nc(-c3ccc(OCC(=O)NC4CC(C)(C)N([O])C(C)(C)C4)cc3)[nH]c2C1=O | 10.1021/jm049513x | |||
| 155524516 | 170965 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 432 | 5 | 2 | 7 | 0.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4455937 | 170965 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 432 | 5 | 2 | 7 | 0.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 45268873 | 196748 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 532 | 10 | 2 | 9 | 2.1 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NN4CCc5ccccc5C4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL565192 | 196748 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 3 | ChEMBL | 532 | 10 | 2 | 9 | 2.1 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NN4CCc5ccccc5C4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 136042335 | 71160 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 490 | 8 | 2 | 10 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc(=O)c5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955911 | 71160 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 490 | 8 | 2 | 10 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc(=O)c5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 168273637 | 190314 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OS(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5176227 | 190314 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OS(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 168272084 | 190280 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cccc(N=C=S)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5175698 | 190280 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cccc(N=C=S)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 11662264 | 77281 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 444 | 7 | 1 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(F)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL208143 | 77281 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 444 | 7 | 1 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(F)ccc4Cl)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 2980395 | 139005 | None | 13 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL3785635 | 139005 | None | 13 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 | 10.1021/acs.jmedchem.0c00564 | |||
| 2980395 | 139005 | None | 13 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785635 | 139005 | None | 13 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 | 10.1021/acs.jmedchem.5b01586 | |||
| 2980395 | 139005 | None | 13 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3785635 | 139005 | None | 13 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 339 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cccs1 | 10.1021/acs.jmedchem.9b01340 | |||
| 44390528 | 122612 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 2 | 2 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(C(F)(F)F)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL360280 | 122612 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 2 | 2 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(C(F)(F)F)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 52941244 | 19249 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -1 | 2 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290209 | 19249 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -1 | 2 | ChEMBL | 509 | 9 | 2 | 5 | 5.7 | C[C@@H](NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 45273099 | 195624 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 10 | 2 | ChEMBL | 378 | 9 | 1 | 8 | 1.9 | CCSCCn1c(=O)c2[nH]c(-c3ccco3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL556264 | 195624 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 10 | 2 | ChEMBL | 378 | 9 | 1 | 8 | 1.9 | CCSCCn1c(=O)c2[nH]c(-c3ccco3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 10219934 | 96286 | None | 8 | Human | Binding | pKi | = | 5.3 | 5.3 | 1 | 3 | ChEMBL | 208 | 1 | 1 | 5 | 0.0 | CC(C)n1c(=O)n(C)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL26119 | 96286 | None | 8 | Human | Binding | pKi | = | 5.3 | 5.3 | 1 | 3 | ChEMBL | 208 | 1 | 1 | 5 | 0.0 | CC(C)n1c(=O)n(C)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 10737168 | 165333 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -288 | 6 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL423542 | 165333 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -288 | 6 | ChEMBL | 359 | 5 | 1 | 8 | 2.9 | Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 50940980 | 57283 | None | 2 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 283 | 4 | 1 | 5 | 3.3 | CCC(=O)Nc1cc(-c2ccoc2)nc(-c2ccoc2)n1 | 10.1021/jm100843z | |||
| CHEMBL1650391 | 57283 | None | 2 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 283 | 4 | 1 | 5 | 3.3 | CCC(=O)Nc1cc(-c2ccoc2)nc(-c2ccoc2)n1 | 10.1021/jm100843z | |||
| 136042335 | 71160 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 490 | 8 | 2 | 10 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc(=O)c5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955911 | 71160 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 490 | 8 | 2 | 10 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc(=O)c5ccccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 21958762 | 155778 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 288 | 4 | 2 | 6 | 0.7 | CCCn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL405901 | 155778 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 3 | 3 | ChEMBL | 288 | 4 | 2 | 6 | 0.7 | CCCn1c(=O)c2[nH]c(-c3cn[nH]c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 155511760 | 169608 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC(C)OC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4436567 | 169608 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC(C)OC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 122227309 | 177662 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 322 | 3 | 2 | 5 | 3.2 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccc[nH]1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4641601 | 177662 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 322 | 3 | 2 | 5 | 3.2 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccc[nH]1 | 10.1021/acs.jmedchem.0c00564 | |||
| 44588472 | 172610 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -2 | 2 | ChEMBL | 341 | 6 | 1 | 5 | 3.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OC)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL449133 | 172610 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -2 | 2 | ChEMBL | 341 | 6 | 1 | 5 | 3.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OC)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL5075422 | 214370 | None | 3 | Human | Binding | pKi | = | 6.3 | 6.3 | -87 | 4 | ChEMBL | None | None | None | Cn1cc(-c2cnc(N)n3nc(-c4ccco4)nc23)ccc1=O | 10.1021/acsmedchemlett.1c00599 | |||||
| 71570366 | 86149 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -11 | 3 | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3OC)n2)c1OC | 10.1016/j.ejmech.2012.11.010 | |||
| CHEMBL2311745 | 86149 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -11 | 3 | ChEMBL | 409 | 7 | 1 | 7 | 3.8 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3OC)n2)c1OC | 10.1016/j.ejmech.2012.11.010 | |||
| 44236567 | 157300 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 430 | 6 | 1 | 7 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4077090 | 157300 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 430 | 6 | 1 | 7 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44236420 | 156233 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 518 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(C)cc5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4064755 | 156233 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 518 | 8 | 1 | 9 | 2.2 | CCCn1c(=O)c2[nH]c(-c3cnn(CC(=O)N4CCN(c5ccc(C)cc5)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 21958775 | 94771 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | ChEMBL | 380 | 5 | 2 | 6 | 1.9 | O=c1[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL253252 | 94771 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | ChEMBL | 380 | 5 | 2 | 6 | 1.9 | O=c1[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| 10246959 | 58762 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -15 | 6 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| CHEMBL16867 | 58762 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -15 | 6 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm030852k | |||
| 46880375 | 5937 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 29 | 4 | ChEMBL | 339 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(-c2ccncc2Cl)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1079803 | 5937 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 29 | 4 | ChEMBL | 339 | 4 | 1 | 4 | 4.4 | O=C(Nc1ccc(-c2ccncc2Cl)c(-c2ccco2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 46880419 | 6338 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 2 | 4 | ChEMBL | 319 | 4 | 1 | 4 | 4.1 | Cc1ccc(-c2nc(NC(=O)C3CC3)ccc2-c2ccncc2)o1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082005 | 6338 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 2 | 4 | ChEMBL | 319 | 4 | 1 | 4 | 4.1 | Cc1ccc(-c2nc(NC(=O)C3CC3)ccc2-c2ccncc2)o1 | 10.1016/j.bmcl.2010.01.045 | |||
| 136042350 | 71148 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 30 | 2 | ChEMBL | 496 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955899 | 71148 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 30 | 2 | ChEMBL | 496 | 8 | 2 | 9 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11610638 | 166192 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 57 | 3 | ChEMBL | 382 | 5 | 1 | 7 | 2.0 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL426504 | 166192 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 57 | 3 | ChEMBL | 382 | 5 | 1 | 7 | 2.0 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm7014815 | |||
| 53248700 | 60732 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 3 | ChEMBL | 536 | 5 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1760899 | 60732 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 3 | ChEMBL | 536 | 5 | 2 | 6 | 5.2 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)N3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 11610638 | 166192 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 57 | 3 | ChEMBL | 382 | 5 | 1 | 7 | 2.0 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL426504 | 166192 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 57 | 3 | ChEMBL | 382 | 5 | 1 | 7 | 2.0 | CCn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2n(CC)c1=O | 10.1021/jm051268+ | |||
| 10246959 | 58762 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -15 | 6 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL16867 | 58762 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -15 | 6 | ChEMBL | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 11576491 | 74446 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 20 | 2 | ChEMBL | 474 | 9 | 2 | 6 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL202766 | 74446 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 20 | 2 | ChEMBL | 474 | 9 | 2 | 6 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11497055 | 74447 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 7 | 2 | ChEMBL | 504 | 10 | 2 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)Nc4ccc(OC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL202767 | 74447 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 7 | 2 | ChEMBL | 504 | 10 | 2 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)Nc4ccc(OC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11649145 | 135202 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 1 | 5 | ChEMBL | 508 | 8 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL372148 | 135202 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 1 | 5 | ChEMBL | 508 | 8 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(-c5ccccc5)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451283 | 96461 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 20 | 4 | ChEMBL | 473 | 5 | 1 | 7 | 2.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL262332 | 96461 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 20 | 4 | ChEMBL | 473 | 5 | 1 | 7 | 2.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44236539 | 156790 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4070936 | 156790 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 460 | 7 | 2 | 8 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(C(=O)O)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 71452718 | 78921 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 7 | 4 | ChEMBL | 491 | 10 | 4 | 7 | 2.5 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)O)cc4)cc3)nc2c1=O | 10.1021/jm049513x | |||
| CHEMBL2112962 | 78921 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 7 | 4 | ChEMBL | 491 | 10 | 4 | 7 | 2.5 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)O)cc4)cc3)nc2c1=O | 10.1021/jm049513x | |||
| 10863910 | 140837 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 7 | 4 | ChEMBL | 491 | 9 | 3 | 8 | 2.7 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)OC)cc4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL38193 | 140837 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 7 | 4 | ChEMBL | 491 | 9 | 3 | 8 | 2.7 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)OC)cc4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 10050439 | 206334 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -1 | 3 | ChEMBL | 471 | 7 | 2 | 9 | 2.2 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL8732 | 206334 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -1 | 3 | ChEMBL | 471 | 7 | 2 | 9 | 2.2 | CCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| 57988776 | 156657 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 519 | 9 | 1 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(F)cc5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4069458 | 156657 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 519 | 9 | 1 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5ccc(F)cc5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 162650047 | 180066 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -69 | 2 | ChEMBL | 393 | 5 | 2 | 7 | 3.0 | COc1nc(-c2ncco2)nc(N)c1C(=O)NCc1c(Cl)cccc1Cl | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL4747929 | 180066 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -69 | 2 | ChEMBL | 393 | 5 | 2 | 7 | 3.0 | COc1nc(-c2ncco2)nc(N)c1C(=O)NCc1c(Cl)cccc1Cl | 10.1021/acs.jmedchem.0c00237 | |||
| 44185934 | 186708 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 14 | 4 | ChEMBL | 403 | 4 | 2 | 6 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL488542 | 186708 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 14 | 4 | ChEMBL | 403 | 4 | 2 | 6 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 168297138 | 192239 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(OS(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5205220 | 192239 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(OS(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm0309654 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm900413e | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm900413e | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm900413e | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.5b01586 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/acs.jmedchem.5b01586 | |||
| 44236601 | 157579 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(OC(F)(F)F)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4080646 | 157579 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 500 | 7 | 1 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(OC(F)(F)F)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44450982 | 100973 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 120 | 4 | ChEMBL | 576 | 8 | 1 | 6 | 5.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL294223 | 100973 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 120 | 4 | ChEMBL | 576 | 8 | 1 | 6 | 5.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2016.11.007 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.ejmech.2016.11.007 | |||
| 10226014 | 94589 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL252048 | 94589 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1021/acs.jmedchem.1c00261 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1021/jm201292w | |||
| 136042343 | 71167 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 11 | 2 | ChEMBL | 501 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955919 | 71167 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 11 | 2 | ChEMBL | 501 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(Cl)c(F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmc.2007.11.058 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.3 | 8.3 | 21 | 4 | ChEMBL | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 10.1016/j.bmc.2007.11.058 | |||
| 10895702 | 139178 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 3 | ChEMBL | 454 | 8 | 2 | 7 | 1.4 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(CC)CC4)cc3)nc2c1=O | 10.1021/jm049513x | |||
| CHEMBL37875 | 139178 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 3 | ChEMBL | 454 | 8 | 2 | 7 | 1.4 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(CC)CC4)cc3)nc2c1=O | 10.1021/jm049513x | |||
| 10895702 | 139178 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 3 | ChEMBL | 454 | 8 | 2 | 7 | 1.4 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(CC)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37875 | 139178 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 3 | 3 | ChEMBL | 454 | 8 | 2 | 7 | 1.4 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(CC)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 11510702 | 73116 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 11 | 2 | ChEMBL | 450 | 7 | 2 | 6 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201127 | 73116 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 11 | 2 | ChEMBL | 450 | 7 | 2 | 6 | 3.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44450982 | 100973 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 120 | 4 | ChEMBL | 576 | 8 | 1 | 6 | 5.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL294223 | 100973 | None | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 120 | 4 | ChEMBL | 576 | 8 | 1 | 6 | 5.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 155552405 | 174053 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 25 | 2 | ChEMBL | 522 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(C(=O)c5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4543948 | 174053 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 25 | 2 | ChEMBL | 522 | 6 | 2 | 7 | 1.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(C(=O)c5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44451100 | 156884 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 109 | 2 | ChEMBL | 592 | 7 | 1 | 9 | 4.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL407202 | 156884 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 109 | 2 | ChEMBL | 592 | 7 | 1 | 9 | 4.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5nc6ccc(Cl)cc6s5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 11621020 | 72792 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 558 | 7 | 2 | 6 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL200052 | 72792 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 558 | 7 | 2 | 6 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(I)cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44236503 | 158057 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 434 | 6 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(F)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4086077 | 158057 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 434 | 6 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(F)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44574252 | 178480 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 1 | 2 | ChEMBL | 450 | 8 | 3 | 7 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cc[nH]n4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL466453 | 178480 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 1 | 2 | ChEMBL | 450 | 8 | 3 | 7 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cc[nH]n4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 145967791 | 164820 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 10 | 6 | ChEMBL | 659 | 12 | 3 | 7 | 5.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4218673 | 164820 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 10 | 6 | ChEMBL | 659 | 12 | 3 | 7 | 5.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 10196114 | 63971 | None | 11 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(OC)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL180693 | 63971 | None | 11 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(OC)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 135465774 | 111477 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 64 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32770 | 111477 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 64 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135465774 | 111477 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 64 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32770 | 111477 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 64 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10196114 | 63971 | None | 11 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(OC)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL180693 | 63971 | None | 11 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(OC)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm201292w | |||
| 10905799 | 119908 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -7 | 4 | ChEMBL | 416 | 6 | 2 | 8 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL349240 | 119908 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -7 | 4 | ChEMBL | 416 | 6 | 2 | 8 | 4.2 | CCCCn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 44588515 | 175155 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 2 | ChEMBL | 372 | 6 | 2 | 7 | 2.6 | CCCn1c(=O)c2[nH]c(-c3ccc([N+](=O)[O-])cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457014 | 175155 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 2 | 2 | ChEMBL | 372 | 6 | 2 | 7 | 2.6 | CCCn1c(=O)c2[nH]c(-c3ccc([N+](=O)[O-])cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00237 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/jm4011669 | |||
| CHEMBL5084351 | 214908 | None | 4 | Human | Binding | pKi | = | 7.3 | 7.3 | -33 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(N)nc1-c1cccc(O)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 56844240 | 1108 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -11 | 3 | ChEMBL | 277 | 2 | 1 | 5 | 2.8 | Nc1nnc(c(n1)c1ccccc1)c1cc(C)nc(c1)C | 10.1021/jm201376w | |||
| 9236 | 1108 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -11 | 3 | ChEMBL | 277 | 2 | 1 | 5 | 2.8 | Nc1nnc(c(n1)c1ccccc1)c1cc(C)nc(c1)C | 10.1021/jm201376w | |||
| CHEMBL2024115 | 1108 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -11 | 3 | ChEMBL | 277 | 2 | 1 | 5 | 2.8 | Nc1nnc(c(n1)c1ccccc1)c1cc(C)nc(c1)C | 10.1021/jm201376w | |||
| 137636304 | 156199 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -691 | 3 | ChEMBL | 419 | 4 | 2 | 7 | 3.4 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(C)(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4064207 | 156199 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -691 | 3 | ChEMBL | 419 | 4 | 2 | 7 | 3.4 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C3(C)CCC(C)(O)CC3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 132941757 | 158897 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -870 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 4.4 | CCN(CC)C1CCC(C)(C(=O)Nc2nc3c(OC)ccc(N4CCOCC4)c3s2)CC1 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4095355 | 158897 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -870 | 3 | ChEMBL | 460 | 7 | 1 | 7 | 4.4 | CCN(CC)C1CCC(C)(C(=O)Nc2nc3c(OC)ccc(N4CCOCC4)c3s2)CC1 | 10.1021/acs.jmedchem.6b01584 | |||
| 145973260 | 164596 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -11481 | 4 | ChEMBL | 568 | 9 | 1 | 14 | 1.5 | COCCOc1ccc(N2CCN(CCn3c(=O)n(C)c4c3nc(N)n3nc(-c5nccs5)nc43)CC2)cc1F | 10.1021/acsmedchemlett.7b00175 | |||
| CHEMBL4215754 | 164596 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -11481 | 4 | ChEMBL | 568 | 9 | 1 | 14 | 1.5 | COCCOc1ccc(N2CCN(CCn3c(=O)n(C)c4c3nc(N)n3nc(-c5nccs5)nc43)CC2)cc1F | 10.1021/acsmedchemlett.7b00175 | |||
| 11618368 | 3845 | None | 77 | Human | Binding | pKi | = | 5.3 | 5.3 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.6b01584 | |||
| 5611 | 3845 | None | 77 | Human | Binding | pKi | = | 5.3 | 5.3 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL2105747 | 3845 | None | 77 | Human | Binding | pKi | = | 5.3 | 5.3 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.6b01584 | |||
| DB12203 | 3845 | None | 77 | Human | Binding | pKi | = | 5.3 | 5.3 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.6b01584 | |||
| 137634085 | 156287 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -1258 | 4 | ChEMBL | 463 | 6 | 1 | 7 | 4.2 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)c(F)c3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| CHEMBL4065326 | 156287 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -1258 | 4 | ChEMBL | 463 | 6 | 1 | 7 | 4.2 | COc1ccc(N2CCOCC2)c2sc(NC(=O)C(C)(C)Oc3ccc(F)c(F)c3)nc12 | 10.1021/acs.jmedchem.6b01584 | |||
| 44574223 | 178709 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 6 | 2 | ChEMBL | 466 | 8 | 2 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL468306 | 178709 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 6 | 2 | ChEMBL | 466 | 8 | 2 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccsc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 44452435 | 96610 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -39 | 4 | ChEMBL | 383 | 5 | 1 | 6 | 4.1 | O=C(CCc1ccccc1)Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL263372 | 96610 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -39 | 4 | ChEMBL | 383 | 5 | 1 | 6 | 4.1 | O=C(CCc1ccccc1)Nc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 10346511 | 103045 | None | 5 | Human | Binding | pKi | = | 5.3 | 5.3 | -2754 | 8 | ChEMBL | 517 | 5 | 4 | 9 | 1.3 | OC[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm9905965 | |||
| CHEMBL307199 | 103045 | None | 5 | Human | Binding | pKi | = | 5.3 | 5.3 | -2754 | 8 | ChEMBL | 517 | 5 | 4 | 9 | 1.3 | OC[C@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)nc(Cl)nc32)[C@H](O)[C@@H]1O | 10.1021/jm9905965 | |||
| 11995448 | 141457 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -22 | 3 | ChEMBL | 473 | 9 | 2 | 8 | 2.0 | CCCn1c(=O)c2nc([C@]34CC[C@](C(=O)NCCC(=O)OC)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL384257 | 141457 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -22 | 3 | ChEMBL | 473 | 9 | 2 | 8 | 2.0 | CCCn1c(=O)c2nc([C@]34CC[C@](C(=O)NCCC(=O)OC)(CC3)CC4)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 24827556 | 159778 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 2 | 3 | ChEMBL | 381 | 5 | 1 | 8 | 0.8 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccc[n+]([O-])c4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| CHEMBL410529 | 159778 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 2 | 3 | ChEMBL | 381 | 5 | 1 | 8 | 0.8 | CCCn1c(=O)c2[nH]c(-c3cnn(-c4ccc[n+]([O-])c4)c3)nc2n(CC)c1=O | 10.1021/jm7014815 | |||
| 156015785 | 177615 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -2 | 4 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnco1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4640980 | 177615 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -2 | 4 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cnco1 | 10.1021/acs.jmedchem.0c00564 | |||
| 135493292 | 100276 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 512 | 11 | 2 | 11 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)no3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL289002 | 100276 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 512 | 11 | 2 | 11 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)c(OC)c4)no3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135485985 | 98577 | None | 43 | Human | Binding | pKi | = | 7.3 | 7.3 | -2 | 6 | ChEMBL | 241 | 1 | 2 | 7 | 0.8 | Nc1nc2n[nH]cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL276738 | 98577 | None | 43 | Human | Binding | pKi | = | 7.3 | 7.3 | -2 | 6 | ChEMBL | 241 | 1 | 2 | 7 | 0.8 | Nc1nc2n[nH]cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 137650430 | 157197 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 290 | 3 | 2 | 5 | 1.7 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1cccs1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4075899 | 157197 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 290 | 3 | 2 | 5 | 1.7 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1cccs1 | 10.1021/acs.jmedchem.7b00138 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2010.09.043 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2010.09.043 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2010.09.043 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1016/j.bmc.2010.09.043 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm049513x | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm049513x | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm049513x | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm049513x | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm011049y | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm011049y | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm011049y | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm011049y | |||
| 137660466 | 159285 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -2 | 3 | ChEMBL | 288 | 3 | 1 | 2 | 4.4 | CC(=O)Nc1cc(-c2ccccc2)cc(-c2ccccc2)n1 | 10.1021/acs.jmedchem.7b00860 | |||
| CHEMBL4099480 | 159285 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -2 | 3 | ChEMBL | 288 | 3 | 1 | 2 | 4.4 | CC(=O)Nc1cc(-c2ccccc2)cc(-c2ccccc2)n1 | 10.1021/acs.jmedchem.7b00860 | |||
| 11495410 | 72691 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 3 | 2 | ChEMBL | 418 | 6 | 2 | 6 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199688 | 72691 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 3 | 2 | ChEMBL | 418 | 6 | 2 | 6 | 1.9 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccccc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 11590453 | 72722 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 6 | 2 | ChEMBL | 448 | 7 | 2 | 7 | 1.9 | COc1cccc(CNC(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)c1 | 10.1021/jm0506221 | |||
| CHEMBL199826 | 72722 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 6 | 2 | ChEMBL | 448 | 7 | 2 | 7 | 1.9 | COc1cccc(CNC(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)c1 | 10.1021/jm0506221 | |||
| 44451480 | 95804 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 45 | 2 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1ccccc1N1CCN(C(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258778 | 95804 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 45 | 2 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1ccccc1N1CCN(C(=O)COc2ccc(-c3cc4c([nH]3)c(=O)n(C)c(=O)n4C)cc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 44451201 | 96129 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 30 | 2 | ChEMBL | 619 | 11 | 1 | 7 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(c5ccccc5)c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260434 | 96129 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 30 | 2 | ChEMBL | 619 | 11 | 1 | 7 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(c5ccccc5)c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 168273637 | 190314 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OS(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5176227 | 190314 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OS(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5079596 | 214623 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -1 | 2 | ChEMBL | None | None | None | N#Cc1c(-c2ccccc2)nc(Nc2ccccc2)nc1-c1ccc(F)cc1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 14978313 | 102653 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 4 | 5 | ChEMBL | 204 | 1 | 1 | 5 | -0.9 | C#CCn1c(=O)c2[nH]cnc2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL304455 | 102653 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 4 | 5 | ChEMBL | 204 | 1 | 1 | 5 | -0.9 | C#CCn1c(=O)c2[nH]cnc2n(C)c1=O | 10.1021/jm0104318 | |||
| 165412580 | 192000 | None | 4 | Human | Binding | pKi | = | 6.3 | 6.3 | -50 | 3 | ChEMBL | 450 | 11 | 3 | 9 | 3.6 | Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)c3)c2n1 | 10.1016/j.ejmech.2022.114326 | |||
| CHEMBL5201523 | 192000 | None | 4 | Human | Binding | pKi | = | 6.3 | 6.3 | -50 | 3 | ChEMBL | 450 | 11 | 3 | 9 | 3.6 | Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)c3)c2n1 | 10.1016/j.ejmech.2022.114326 | |||
| 12351799 | 189318 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 4 | 2 | ChEMBL | 285 | 1 | 2 | 5 | 1.2 | Cc1ccc(-c2[nH]c3c(=O)n(C)c(=O)n(C)c3c2O)cc1 | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL512388 | 189318 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 4 | 2 | ChEMBL | 285 | 1 | 2 | 5 | 1.2 | Cc1ccc(-c2[nH]c3c(=O)n(C)c(=O)n(C)c3c2O)cc1 | 10.1016/j.bmc.2008.09.067 | |||
| 11313850 | 111573 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 341 | 5 | 1 | 7 | 2.0 | CCCn1c(=O)c2c(nc(-c3ccc(N)cc3)n2C)n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32814 | 111573 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 341 | 5 | 1 | 7 | 2.0 | CCCn1c(=O)c2c(nc(-c3ccc(N)cc3)n2C)n(CCC)c1=O | 10.1021/jm0309654 | |||
| 156020536 | 178147 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 336 | 3 | 2 | 5 | 3.6 | CC1=C(C(=O)OC(C)C)C(c2cc[nH]c2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4648862 | 178147 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 336 | 3 | 2 | 5 | 3.6 | CC1=C(C(=O)OC(C)C)C(c2cc[nH]c2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 21958721 | 64131 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(Cl)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL180832 | 64131 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(Cl)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 11494318 | 72254 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -10 | 3 | ChEMBL | 215 | 1 | 1 | 7 | 0.1 | Cn1c(-n2nccn2)nc2c(N)nccc21 | 10.1021/jm058018d | |||
| CHEMBL198200 | 72254 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -10 | 3 | ChEMBL | 215 | 1 | 1 | 7 | 0.1 | Cn1c(-n2nccn2)nc2c(N)nccc21 | 10.1021/jm058018d | |||
| 2099 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | ChEMBL | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 10.1021/jm0104318 | |||
| 4740 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | ChEMBL | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 10.1021/jm0104318 | |||
| 7095 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | ChEMBL | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 10.1021/jm0104318 | |||
| CHEMBL628 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | ChEMBL | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 10.1021/jm0104318 | |||
| DB00806 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | ChEMBL | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 10.1021/jm0104318 | |||
| 10928649 | 58144 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 461 | 7 | 2 | 10 | 4.1 | CCCCn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL167915 | 58144 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -3 | 4 | ChEMBL | 461 | 7 | 2 | 10 | 4.1 | CCCCn1cc2c(nc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 155560449 | 175081 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4568571 | 175081 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccoc2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11613517 | 72726 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 536 | 10 | 2 | 7 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199834 | 72726 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 536 | 10 | 2 | 7 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)=O)cc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 10421804 | 99744 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -5 | 4 | ChEMBL | 241 | 1 | 2 | 3 | 1.2 | Cn1c(=O)[nH]c2cc(-c3ccccc3)[nH]c2c1=O | 10.1021/jm011049y | |||
| CHEMBL284991 | 99744 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | -5 | 4 | ChEMBL | 241 | 1 | 2 | 3 | 1.2 | Cn1c(=O)[nH]c2cc(-c3ccccc3)[nH]c2c1=O | 10.1021/jm011049y | |||
| 155533281 | 171830 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 304 | 3 | 2 | 4 | 2.0 | CCOC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4468661 | 171830 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 304 | 3 | 2 | 4 | 2.0 | CCOC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccoc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 168276821 | 190105 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(OS(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5172969 | 190105 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(OS(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 52949755 | 19236 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -1 | 2 | ChEMBL | 468 | 6 | 2 | 5 | 3.2 | Cc1c(S(C)(=O)=O)c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290103 | 19236 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -1 | 2 | ChEMBL | 468 | 6 | 2 | 5 | 3.2 | Cc1c(S(C)(=O)=O)c(=O)[nH]c2ccc(OCC(=O)NCc3ccc(Cl)c(Cl)c3)cc12 | 10.1016/j.bmcl.2010.10.030 | |||
| 21958676 | 63907 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 1 | 2 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(C)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL180559 | 63907 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 1 | 2 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccc(C)cc5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 135529372 | 110109 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 482 | 10 | 2 | 10 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)cc4)no3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32359 | 110109 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 482 | 10 | 2 | 10 | 2.4 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(OC)cc4)no3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10637742 | 58950 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -33 | 6 | ChEMBL | 297 | 4 | 1 | 8 | 2.1 | CCCCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL16894 | 58950 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -33 | 6 | ChEMBL | 297 | 4 | 1 | 8 | 2.1 | CCCCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 10939224 | 57534 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -173 | 4 | ChEMBL | 446 | 5 | 2 | 10 | 3.5 | CCCn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL166301 | 57534 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -173 | 4 | ChEMBL | 446 | 5 | 2 | 10 | 3.5 | CCCn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 9902563 | 188788 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -23 | 4 | ChEMBL | 341 | 3 | 1 | 8 | 2.4 | Cc1csc(-c2nc(N)nc3c2nnn3Cc2ccccc2F)n1 | 10.1021/jm800961g | |||
| CHEMBL505787 | 188788 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -23 | 4 | ChEMBL | 341 | 3 | 1 | 8 | 2.4 | Cc1csc(-c2nc(N)nc3c2nnn3Cc2ccccc2F)n1 | 10.1021/jm800961g | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.0c01431 | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.0c01431 | |||
| 11416002 | 98486 | None | 2 | Human | Binding | pKi | = | 7.3 | 7.3 | 40 | 3 | ChEMBL | 322 | 2 | 3 | 6 | -0.1 | Cn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL275987 | 98486 | None | 2 | Human | Binding | pKi | = | 7.3 | 7.3 | 40 | 3 | ChEMBL | 322 | 2 | 3 | 6 | -0.1 | Cn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.1c00261 | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.1c00261 | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.1c00261 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm900413e | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm060277v | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm060277v | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm060277v | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.5b01586 | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.5b01586 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.7b00138 | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.7b00138 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/acs.jmedchem.9b00071 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm011049y | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm011049y | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | ChEMBL | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 10.1021/jm011049y | |||
| 44451171 | 96046 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 28 | 2 | ChEMBL | 487 | 6 | 1 | 7 | 2.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259913 | 96046 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 28 | 2 | ChEMBL | 487 | 6 | 1 | 7 | 2.0 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11640619 | 138383 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -9 | 3 | ChEMBL | 433 | 9 | 2 | 6 | 2.3 | CCCN(CCC)S(=O)(=O)c1ccc(-c2nc3c(=O)n(CCC)c(=O)[nH]c3[nH]2)cc1 | 10.1021/jm060277v | |||
| CHEMBL377246 | 138383 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -9 | 3 | ChEMBL | 433 | 9 | 2 | 6 | 2.3 | CCCN(CCC)S(=O)(=O)c1ccc(-c2nc3c(=O)n(CCC)c(=O)[nH]c3[nH]2)cc1 | 10.1021/jm060277v | |||
| 1882 | 90650 | None | 66 | Rat | Binding | pKi | = | 5.3 | 5.3 | -3 | 5 | ChEMBL | 242 | 2 | 0 | 6 | -0.3 | Cn1c(=O)c2c(ncn2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL23903 | 90650 | None | 66 | Rat | Binding | pKi | = | 5.3 | 5.3 | -3 | 5 | ChEMBL | 242 | 2 | 0 | 6 | -0.3 | Cn1c(=O)c2c(ncn2CCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 11798195 | 121690 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 1 | 4 | ChEMBL | 460 | 7 | 2 | 9 | 4.4 | COc1ccc(NC(=O)Nc2nc3nn(CCC(C)C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL358735 | 121690 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 1 | 4 | ChEMBL | 460 | 7 | 2 | 9 | 4.4 | COc1ccc(NC(=O)Nc2nc3nn(CCC(C)C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 44588395 | 189782 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -1 | 4 | ChEMBL | 327 | 5 | 2 | 5 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccccc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL516154 | 189782 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -1 | 4 | ChEMBL | 327 | 5 | 2 | 5 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccccc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 21958758 | 72882 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 48 | 4 | ChEMBL | 474 | 8 | 1 | 10 | 3.0 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(C)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200349 | 72882 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 48 | 4 | ChEMBL | 474 | 8 | 1 | 10 | 3.0 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(C)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11517635 | 74946 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 18 | 2 | ChEMBL | 432 | 6 | 1 | 6 | 2.3 | CN(Cc1ccccc1)C(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1021/jm0506221 | |||
| CHEMBL203196 | 74946 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 18 | 2 | ChEMBL | 432 | 6 | 1 | 6 | 2.3 | CN(Cc1ccccc1)C(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 | 10.1021/jm0506221 | |||
| 71681055 | 90205 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 330 | 5 | 1 | 5 | 3.7 | O=C(CCCc1ccccc1)Nc1nc2ccsc2c(=O)s1 | 10.1021/jm400336x | |||
| CHEMBL2382424 | 90205 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 330 | 5 | 1 | 5 | 3.7 | O=C(CCCc1ccccc1)Nc1nc2ccsc2c(=O)s1 | 10.1021/jm400336x | |||
| 46227980 | 201888 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 2 | 2 | ChEMBL | 368 | 6 | 1 | 7 | 2.4 | C=CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL607371 | 201888 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | 2 | 2 | ChEMBL | 368 | 6 | 1 | 7 | 2.4 | C=CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 135522391 | 117092 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 552 | 9 | 1 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(c5ccc(F)cc5)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33930 | 117092 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 552 | 9 | 1 | 10 | 2.0 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(c5ccc(F)cc5)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135915277 | 157349 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 451 | 7 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC#Cc4cccc(F)c4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4077765 | 157349 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 451 | 7 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC#Cc4cccc(F)c4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44406639 | 72590 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 23 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(C(F)(F)F)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL199309 | 72590 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 23 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccc(C(F)(F)F)cc5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 135805568 | 139126 | None | 2 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 288 | 3 | 1 | 7 | 2.1 | CC1=C(C(=O)OC(C)C)C(c2ccco2)n2ncnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3786944 | 139126 | None | 2 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 288 | 3 | 1 | 7 | 2.1 | CC1=C(C(=O)OC(C)C)C(c2ccco2)n2ncnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 11153 | 2006 | None | 46 | Human | Binding | pKi | = | 7.3 | 7.3 | -35 | 4 | ChEMBL | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 10.1021/acs.jmedchem.2c00101 | |||
| 86676119 | 2006 | None | 46 | Human | Binding | pKi | = | 7.3 | 7.3 | -35 | 4 | ChEMBL | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 10.1021/acs.jmedchem.2c00101 | |||
| CHEMBL4594442 | 2006 | None | 46 | Human | Binding | pKi | = | 7.3 | 7.3 | -35 | 4 | ChEMBL | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 10.1021/acs.jmedchem.2c00101 | |||
| DB16192 | 2006 | None | 46 | Human | Binding | pKi | = | 7.3 | 7.3 | -35 | 4 | ChEMBL | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 10.1021/acs.jmedchem.2c00101 | |||
| 10219753 | 203671 | None | 2 | Human | Binding | pKi | = | 6.3 | 6.3 | 5 | 3 | ChEMBL | 190 | 1 | 2 | 4 | -1.0 | C#CCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| CHEMBL67415 | 203671 | None | 2 | Human | Binding | pKi | = | 6.3 | 6.3 | 5 | 3 | ChEMBL | 190 | 1 | 2 | 4 | -1.0 | C#CCn1c(=O)[nH]c2[nH]cnc2c1=O | 10.1021/jm0104318 | |||
| 13525048 | 98177 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | 2 | 3 | ChEMBL | 300 | 2 | 2 | 6 | 0.3 | Cn1c(=O)c2nc(-c3cccc(C(=O)O)c3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL273953 | 98177 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | 2 | 3 | ChEMBL | 300 | 2 | 2 | 6 | 0.3 | Cn1c(=O)c2nc(-c3cccc(C(=O)O)c3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 10869347 | 203642 | None | 0 | Rat | Binding | pKi | = | 5.3 | 5.3 | -8 | 4 | ChEMBL | 270 | 3 | 1 | 5 | 0.7 | Cn1c(=O)n(CCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL67228 | 203642 | None | 0 | Rat | Binding | pKi | = | 5.3 | 5.3 | -8 | 4 | ChEMBL | 270 | 3 | 1 | 5 | 0.7 | Cn1c(=O)n(CCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 44410403 | 76007 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -2884 | 4 | ChEMBL | 458 | 5 | 5 | 10 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC4(O)CCCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL205531 | 76007 | None | 0 | Human | Binding | pKi | = | 5.3 | 5.3 | -2884 | 4 | ChEMBL | 458 | 5 | 5 | 10 | 0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC4(O)CCCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 44390583 | 64287 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5OC)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181005 | 64287 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 516 | 10 | 1 | 10 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5ccccc5OC)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 135529391 | 481 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 438 | 481 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL285900 | 481 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 135529391 | 481 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 438 | 481 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| CHEMBL285900 | 481 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 10.1021/jm0309654 | |||
| 16071780 | 58020 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 15 | 2 | ChEMBL | 307 | 4 | 1 | 6 | 2.5 | O=C(Nc1cnc(-c2ccncc2)c(-c2ncco2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672624 | 58020 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 15 | 2 | ChEMBL | 307 | 4 | 1 | 6 | 2.5 | O=C(Nc1cnc(-c2ccncc2)c(-c2ncco2)n1)C1CC1 | 10.1021/ml100249e | |||
| 135874431 | 96254 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 463 | 8 | 2 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL261028 | 96254 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 463 | 8 | 2 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(C)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm051268+ | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm051268+ | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm051268+ | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm051268+ | |||
| 11519405 | 72752 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 532 | 11 | 2 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)OCC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199898 | 72752 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 1 | 2 | ChEMBL | 532 | 11 | 2 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)OCC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 18079460 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091704 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 18079460 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/ml400185v | |||
| CHEMBL3091704 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/ml400185v | |||
| 18079460 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3091704 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 18079460 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL3091704 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 18079460 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL3091704 | 103846 | None | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.3 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 162675859 | 183320 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 290 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CCC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4797364 | 183320 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 290 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CCC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 168276821 | 190105 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(OS(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5172969 | 190105 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 410 | 7 | 1 | 8 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(OS(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 76011 | 203655 | None | 8 | Human | Binding | pKi | = | 5.3 | 5.3 | 2 | 3 | ChEMBL | 256 | 3 | 0 | 6 | 0.1 | Cn1c(=O)c2c(ncn2CCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL67323 | 203655 | None | 8 | Human | Binding | pKi | = | 5.3 | 5.3 | 2 | 3 | ChEMBL | 256 | 3 | 0 | 6 | 0.1 | Cn1c(=O)c2c(ncn2CCCCl)n(C)c1=O | 10.1021/jm0104318 | |||
| 135443324 | 111438 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 393 | 4 | 2 | 8 | 0.5 | Cn1nc(NC(=O)Cc2ccccc2)cc1-c1nc2c(=O)n(C)c(=O)n(C)c2[nH]1 | 10.1021/jm0309654 | |||
| CHEMBL32750 | 111438 | None | 0 | Human | Binding | pKi | = | 6.3 | 6.3 | - | 1 | ChEMBL | 393 | 4 | 2 | 8 | 0.5 | Cn1nc(NC(=O)Cc2ccccc2)cc1-c1nc2c(=O)n(C)c(=O)n(C)c2[nH]1 | 10.1021/jm0309654 | |||
| 9910926 | 29329 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -11 | 5 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL138332 | 29329 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -11 | 5 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 9910926 | 29329 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -11 | 5 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL138332 | 29329 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -11 | 5 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 9869262 | 104859 | None | 0 | Rat | Binding | pKi | = | 7.2 | 7.2 | -9 | 3 | ChEMBL | 468 | 11 | 4 | 6 | 4.8 | Oc1ccc(C[C@H]2CCCN2CCCCCCN2CCC[C@@H]2Cc2ccc(O)c(O)c2)cc1O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL310997 | 104859 | None | 0 | Rat | Binding | pKi | = | 7.2 | 7.2 | -9 | 3 | ChEMBL | 468 | 11 | 4 | 6 | 4.8 | Oc1ccc(C[C@H]2CCCN2CCCCCCN2CCC[C@@H]2Cc2ccc(O)c(O)c2)cc1O | 10.1016/0960-894X(95)00413-N | |||
| 44451169 | 96045 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 25 | 2 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)N1CCN(c2ccccc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259912 | 96045 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 25 | 2 | ChEMBL | 503 | 6 | 1 | 8 | 2.0 | COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)N1CCN(c2ccccc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm900413e | |||
| 155531946 | 171743 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 320 | 3 | 2 | 4 | 2.5 | CCOC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4467283 | 171743 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 320 | 3 | 2 | 4 | 2.5 | CCOC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 162643792 | 181754 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 290 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC2CCCC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4777520 | 181754 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 290 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC2CCCC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 145989810 | 167191 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 4 | ChEMBL | 586 | 14 | 1 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCc3ccccc3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4291422 | 167191 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 4 | ChEMBL | 586 | 14 | 1 | 9 | 4.1 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCc3ccccc3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 137637685 | 155795 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 3 | ChEMBL | 408 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3OC)c2)c1OC | 10.1021/acs.jmedchem.7b00860 | |||
| CHEMBL4059638 | 155795 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 3 | ChEMBL | 408 | 7 | 1 | 6 | 4.4 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3OC)c2)c1OC | 10.1021/acs.jmedchem.7b00860 | |||
| 44281738 | 110643 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 20 | 2 | ChEMBL | 476 | 8 | 3 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Nc4cccc(OC)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32581 | 110643 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 20 | 2 | ChEMBL | 476 | 8 | 3 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Nc4cccc(OC)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135493238 | 116670 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 2 | 2 | ChEMBL | 331 | 5 | 2 | 8 | 0.7 | CCCn1c(=O)c2nc(-c3cc(N)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33709 | 116670 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 2 | 2 | ChEMBL | 331 | 5 | 2 | 8 | 0.7 | CCCn1c(=O)c2nc(-c3cc(N)n(C)n3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 9868763 | 34556 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 5 | 4 | ChEMBL | 458 | 6 | 2 | 9 | 4.4 | COc1ccc(NC(=O)Nc2nc3nn(CC=C(C)C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL142926 | 34556 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 5 | 4 | ChEMBL | 458 | 6 | 2 | 9 | 4.4 | COc1ccc(NC(=O)Nc2nc3nn(CC=C(C)C)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 11503200 | 78093 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 9 | 3 | ChEMBL | 444 | 7 | 1 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(Cl)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210213 | 78093 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 9 | 3 | ChEMBL | 444 | 7 | 1 | 7 | 3.4 | CCCn1c(=O)c2nc(-c3cnn(Cc4cccc(Cl)c4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL5084903 | 214936 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -12 | 5 | ChEMBL | None | None | None | Nc1nc(-c2ccccc2)c2c(n1)-c1cc(OCCCN3CCCCC3)ccc1C2 | 10.1021/acs.jmedchem.0c00914 | |||||
| 44451129 | 96143 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 12 | 2 | ChEMBL | 474 | 5 | 1 | 8 | 1.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccn5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL260495 | 96143 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 12 | 2 | ChEMBL | 474 | 5 | 1 | 8 | 1.4 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccn5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL5076643 | 214454 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -2 | 3 | ChEMBL | None | None | None | Cn1cc(-c2cnc(N)nc2-c2ccco2)ccc1=O | 10.1021/acsmedchemlett.1c00599 | |||||
| 135428645 | 172701 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -204 | 5 | ChEMBL | 371 | 4 | 2 | 4 | 2.9 | CCCN1C(=O)N2C[C@@H](CC)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| CHEMBL450341 | 172701 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -204 | 5 | ChEMBL | 371 | 4 | 2 | 4 | 2.9 | CCCN1C(=O)N2C[C@@H](CC)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21 | 10.1021/jm060539t | |||
| 25027417 | 64478 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 311 | 3 | 2 | 5 | 2.8 | COc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1O | 10.1016/j.ejmech.2012.05.033 | |||
| CHEMBL1814065 | 64478 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 311 | 3 | 2 | 5 | 2.8 | COc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1O | 10.1016/j.ejmech.2012.05.033 | |||
| 21958720 | 63486 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5Cl)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL179935 | 63486 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 520 | 9 | 1 | 9 | 4.7 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5Cl)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 613506 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1606497 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 613506 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL1606497 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| 613506 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL1606497 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| 613506 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL1606497 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| 613506 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL1606497 | 54083 | None | 17 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 250 | 3 | 2 | 4 | 1.5 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| 11380878 | 197752 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -630 | 4 | ChEMBL | 295 | 4 | 2 | 6 | 1.6 | Nc1nc(C(=O)NCc2cccnc2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL571672 | 197752 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -630 | 4 | ChEMBL | 295 | 4 | 2 | 6 | 1.6 | Nc1nc(C(=O)NCc2cccnc2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 155513258 | 169723 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 304 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4438396 | 169723 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 304 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OCC(F)(F)F)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 46233380 | 200679 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -3 | 3 | ChEMBL | 374 | 7 | 1 | 6 | 1.7 | CCCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(CC[S+]([O-])CC)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| CHEMBL599817 | 200679 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -3 | 3 | ChEMBL | 374 | 7 | 1 | 6 | 1.7 | CCCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(CC[S+]([O-])CC)c1=O | 10.1016/j.bmc.2010.01.028 | |||
| 44406930 | 73030 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -2754 | 2 | ChEMBL | 572 | 9 | 1 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)c4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201022 | 73030 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -2754 | 2 | ChEMBL | 572 | 9 | 1 | 7 | 4.2 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)c4ccc(I)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44588396 | 175437 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 341 | 5 | 1 | 6 | 3.0 | CCCn1c(=O)c2c(cc(-c3ccc(C)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457659 | 175437 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 341 | 5 | 1 | 6 | 3.0 | CCCn1c(=O)c2c(cc(-c3ccc(C)cc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 135493286 | 109762 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 40 | 2 | ChEMBL | 493 | 8 | 3 | 9 | 2.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4ccc(N(C)C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32311 | 109762 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 40 | 2 | ChEMBL | 493 | 8 | 3 | 9 | 2.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4ccc(N(C)C)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 21874675 | 178700 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -53 | 4 | ChEMBL | 331 | 3 | 2 | 7 | 2.6 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]ccc4c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL468256 | 178700 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -53 | 4 | ChEMBL | 331 | 3 | 2 | 7 | 2.6 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc4[nH]ccc4c3)c2n1 | 10.1021/jm800961g | |||
| 137658586 | 159307 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 288 | 3 | 2 | 5 | 1.6 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4099777 | 159307 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 288 | 3 | 2 | 5 | 1.6 | CC1=C(C(=O)OC(C)C)C(c2ccoc2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 44308481 | 204014 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 3 | ChEMBL | 374 | 6 | 3 | 8 | 1.8 | CCCn1c(=O)c2nc(-c3cc(O)c(OC)c(O)c3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL69701 | 204014 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 3 | ChEMBL | 374 | 6 | 3 | 8 | 1.8 | CCCn1c(=O)c2nc(-c3cc(O)c(OC)c(O)c3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 10927361 | 90866 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 1 | 4 | ChEMBL | 395 | 7 | 0 | 7 | 2.6 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(CCC)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| CHEMBL239233 | 90866 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 1 | 4 | ChEMBL | 395 | 7 | 0 | 7 | 2.6 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(CCC)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| 21874602 | 176780 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -54 | 4 | ChEMBL | 377 | 5 | 2 | 8 | 2.3 | CC(C)NC(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL460596 | 176780 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -54 | 4 | ChEMBL | 377 | 5 | 2 | 8 | 2.3 | CC(C)NC(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 10158974 | 155504 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 418 | 5 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL404168 | 155504 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 418 | 5 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1021/acs.jmedchem.0c01431 | |||
| 66892382 | 159150 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 1 | 3 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC(F)(F)F)cc5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4098127 | 159150 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 1 | 3 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5ccc(OC(F)(F)F)cc5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 57429661 | 159624 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(C(F)(F)F)c5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4103446 | 159624 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CCN(c5cccc(C(F)(F)F)c5)C4=O)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11774068 | 94562 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 404 | 4 | 2 | 6 | 2.4 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251876 | 94562 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 404 | 4 | 2 | 6 | 2.4 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 21958524 | 94592 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 29 | 4 | ChEMBL | 362 | 5 | 2 | 6 | 1.7 | O=c1[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252069 | 94592 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 29 | 4 | ChEMBL | 362 | 5 | 2 | 6 | 1.7 | O=c1[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c(=O)n1CC1CC1 | 10.1016/j.bmcl.2008.01.008 | |||
| 11953248 | 5520 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 52 | 3 | ChEMBL | 279 | 2 | 2 | 5 | 2.0 | O=c1[nH]c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1076563 | 5520 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 52 | 3 | ChEMBL | 279 | 2 | 2 | 5 | 2.0 | O=c1[nH]c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1 | 10.1016/j.bmcl.2010.01.077 | |||
| 16072019 | 58008 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 75 | 4 | ChEMBL | 280 | 3 | 1 | 5 | 2.8 | CC(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| CHEMBL1672612 | 58008 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 75 | 4 | ChEMBL | 280 | 3 | 1 | 5 | 2.8 | CC(=O)Nc1cnc(-c2ccncc2)c(-c2ccco2)n1 | 10.1021/ml100249e | |||
| 53322692 | 58028 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 67 | 3 | ChEMBL | 325 | 4 | 1 | 6 | 2.7 | O=C(Nc1cnc(-c2ccncc2F)c(-c2ncco2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672632 | 58028 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 67 | 3 | ChEMBL | 325 | 4 | 1 | 6 | 2.7 | O=C(Nc1cnc(-c2ccncc2F)c(-c2ncco2)n1)C1CC1 | 10.1021/ml100249e | |||
| 21958619 | 95933 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 38 | 4 | ChEMBL | 418 | 4 | 1 | 7 | 2.4 | CCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL259342 | 95933 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 38 | 4 | ChEMBL | 418 | 4 | 1 | 7 | 2.4 | CCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 11508923 | 96142 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 38 | 4 | ChEMBL | 368 | 4 | 1 | 7 | 1.5 | CCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL260490 | 96142 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 38 | 4 | ChEMBL | 368 | 4 | 1 | 7 | 1.5 | CCn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 49797906 | 10742 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 467 | 7 | 1 | 7 | 4.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1171165 | 10742 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -1 | 3 | ChEMBL | 467 | 7 | 1 | 7 | 4.3 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3cnn(Cc4cccc(F)c4)c3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 21874647 | 176912 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -2 | 4 | ChEMBL | 324 | 3 | 1 | 7 | 2.6 | Cc1ccc(-c2nc(N)nc3c2nnn3Cc2ccccc2F)o1 | 10.1021/jm800961g | |||
| CHEMBL461857 | 176912 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -2 | 4 | ChEMBL | 324 | 3 | 1 | 7 | 2.6 | Cc1ccc(-c2nc(N)nc3c2nnn3Cc2ccccc2F)o1 | 10.1021/jm800961g | |||
| 135418454 | 16525 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -7 | 4 | ChEMBL | 360 | 4 | 1 | 5 | 4.0 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(C(F)(F)F)cc3)nn12 | 10.1021/jm010570p | |||
| CHEMBL123705 | 16525 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | -7 | 4 | ChEMBL | 360 | 4 | 1 | 5 | 4.0 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(C(F)(F)F)cc3)nn12 | 10.1021/jm010570p | |||
| 11555968 | 73385 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 5 | 2 | ChEMBL | 566 | 10 | 2 | 6 | 5.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(CC)C(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201493 | 73385 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 5 | 2 | ChEMBL | 566 | 10 | 2 | 6 | 5.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(CC)C(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44451074 | 158807 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 79 | 2 | ChEMBL | 535 | 7 | 1 | 7 | 3.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL409443 | 158807 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 79 | 2 | ChEMBL | 535 | 7 | 1 | 7 | 3.5 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5cccc(Cl)c5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 155518147 | 170253 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 27 | 2 | ChEMBL | 554 | 9 | 3 | 9 | 1.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OCCO)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4445941 | 170253 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 27 | 2 | ChEMBL | 554 | 9 | 3 | 9 | 1.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OCCO)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 11730776 | 139388 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 3 | 3 | ChEMBL | 498 | 8 | 2 | 8 | 1.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)OCC)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37933 | 139388 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 3 | 3 | ChEMBL | 498 | 8 | 2 | 8 | 1.6 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(=O)OCC)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 44450979 | 95887 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 66 | 2 | ChEMBL | 530 | 8 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5OC)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259151 | 95887 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 66 | 2 | ChEMBL | 530 | 8 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5OC)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 44450983 | 158879 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 543 | 10 | 1 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL409514 | 158879 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 543 | 10 | 1 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44450983 | 158879 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 543 | 10 | 1 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL409514 | 158879 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 6 | 3 | ChEMBL | 543 | 10 | 1 | 7 | 3.7 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(Cc5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 44236505 | 159637 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 446 | 7 | 1 | 8 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4103585 | 159637 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 446 | 7 | 1 | 8 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(OC)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 7052992 | 183325 | None | 2 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)[C@@H](c2ccco2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4797393 | 183325 | None | 2 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC(C)C)[C@@H](c2ccco2)NC(=S)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 44451284 | 96462 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 56 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL262333 | 96462 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 56 | 2 | ChEMBL | 507 | 5 | 1 | 7 | 2.6 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44451272 | 159584 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 56 | 2 | ChEMBL | 498 | 5 | 1 | 8 | 1.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C#N)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL410297 | 159584 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 56 | 2 | ChEMBL | 498 | 5 | 1 | 8 | 1.8 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(C#N)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44224278 | 156368 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 430 | 6 | 1 | 7 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4066128 | 156368 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 430 | 6 | 1 | 7 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(C)cc4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 66893874 | 159306 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4099762 | 159306 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 543 | 8 | 1 | 8 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44588516 | 188911 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 4 | 4 | ChEMBL | 405 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL507754 | 188911 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 4 | 4 | ChEMBL | 405 | 6 | 2 | 7 | 2.1 | CCCn1c(=O)c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 10863622 | 133409 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 4 | 3 | ChEMBL | 468 | 7 | 2 | 7 | 1.0 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(C)=O)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL37050 | 133409 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 4 | 3 | ChEMBL | 468 | 7 | 2 | 7 | 1.0 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(OCC(=O)N4CCN(C(C)=O)CC4)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 44450933 | 96037 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 36 | 2 | ChEMBL | 543 | 9 | 1 | 7 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259871 | 96037 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 36 | 2 | ChEMBL | 543 | 9 | 1 | 7 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)C(=O)N4CCN(c5ccccc5)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44236659 | 159670 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 434 | 6 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4103997 | 159670 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 434 | 6 | 1 | 7 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(F)c4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 52945195 | 19177 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 3 | 3 | ChEMBL | 525 | 10 | 3 | 6 | 4.7 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)N[C@@H](CO)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289676 | 19177 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 3 | 3 | ChEMBL | 525 | 10 | 3 | 6 | 4.7 | O=C(COc1ccc2[nH]c(=O)c(-c3nccs3)c(CCc3ccccc3)c2c1)N[C@@H](CO)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 11046203 | 99970 | None | 3 | Human | Binding | pKi | = | 8.2 | 8.2 | 8 | 4 | ChEMBL | 344 | 2 | 2 | 4 | 1.5 | C#CCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL286527 | 99970 | None | 3 | Human | Binding | pKi | = | 8.2 | 8.2 | 8 | 4 | ChEMBL | 344 | 2 | 2 | 4 | 1.5 | C#CCn1c(=O)[nH]c2[nH]c(-c3ccc(Br)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 155531840 | 171640 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@H](C)C(F)(F)F)[C@@H](c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4465889 | 171640 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@H](C)C(F)(F)F)[C@@H](c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11533996 | 73235 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 15 | 2 | ChEMBL | 544 | 10 | 2 | 7 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC(F)(F)F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201239 | 73235 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 15 | 2 | ChEMBL | 544 | 10 | 2 | 7 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OC(F)(F)F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11554182 | 140567 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 11 | 2 | ChEMBL | 449 | 6 | 2 | 8 | 2.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc([N+](=O)[O-])cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL381214 | 140567 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 11 | 2 | ChEMBL | 449 | 6 | 2 | 8 | 2.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc([N+](=O)[O-])cc4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44450932 | 96036 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 5 | 2 | ChEMBL | 563 | 9 | 1 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259870 | 96036 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 5 | 2 | ChEMBL | 563 | 9 | 1 | 7 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL5074665 | 214322 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -5 | 3 | ChEMBL | None | None | None | CNc1nc(-c2ccccc2)c(C#N)c(-c2cc(OC)cc(OC)c2)n1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 135874422 | 159083 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)c(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL409736 | 159083 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 509 | 10 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(OC)c(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 21916398 | 95883 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 1 | 4 | ChEMBL | 396 | 5 | 1 | 7 | 2.1 | CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| CHEMBL259130 | 95883 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 1 | 4 | ChEMBL | 396 | 5 | 1 | 7 | 2.1 | CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O | 10.1021/jm7014815 | |||
| 443 | 754 | None | 10 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 7 | ChEMBL | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10.1021/jm011049y | |||
| 6439089 | 754 | None | 10 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 7 | ChEMBL | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10.1021/jm011049y | |||
| CHEMBL16997 | 754 | None | 10 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 7 | ChEMBL | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10.1021/jm011049y | |||
| 11713673 | 72700 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 3 | 2 | ChEMBL | 546 | 12 | 2 | 8 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)OCC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL199722 | 72700 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 3 | 2 | ChEMBL | 546 | 12 | 2 | 8 | 4.1 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CC(=O)OCC)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11634901 | 73510 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 4 | 2 | ChEMBL | 512 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4cccc(F)c4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201679 | 73510 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 4 | 2 | ChEMBL | 512 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4cccc(F)c4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 168271107 | 190067 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5172513 | 190067 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 935972 | 97532 | None | 10 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 3 | ChEMBL | 272 | 1 | 2 | 6 | 0.3 | Cn1c(=O)c2nc(-c3ccc(O)cc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL27047 | 97532 | None | 10 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 3 | ChEMBL | 272 | 1 | 2 | 6 | 0.3 | Cn1c(=O)c2nc(-c3ccc(O)cc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 44574224 | 178590 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 3 | 2 | ChEMBL | 466 | 8 | 2 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cccs4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL467270 | 178590 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 3 | 2 | ChEMBL | 466 | 8 | 2 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cccs4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 135633267 | 139145 | None | 15 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 274 | 3 | 1 | 7 | 1.7 | CCOC(=O)C1=C(C)Nc2ncnn2C1c1ccoc1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3787123 | 139145 | None | 15 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 274 | 3 | 1 | 7 | 1.7 | CCOC(=O)C1=C(C)Nc2ncnn2C1c1ccoc1 | 10.1021/acs.jmedchem.5b01586 | |||
| 2748280 | 20131 | None | 32 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 266 | 3 | 2 | 5 | 2.0 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1304358 | 20131 | None | 32 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 266 | 3 | 2 | 5 | 2.0 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 2748280 | 20131 | None | 32 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 266 | 3 | 2 | 5 | 2.0 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL1304358 | 20131 | None | 32 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 266 | 3 | 2 | 5 | 2.0 | CCOC(=O)C1=C(C)N=C(S)NC1c1ccco1 | 10.1021/ml400185v | |||
| 11798368 | 121923 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 1 | 4 | ChEMBL | 464 | 6 | 2 | 8 | 5.1 | CC(C)CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL359044 | 121923 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 1 | 4 | ChEMBL | 464 | 6 | 2 | 8 | 5.1 | CC(C)CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 10982985 | 120000 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -2 | 4 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL350042 | 120000 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -2 | 4 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 136042337 | 71161 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 520 | 10 | 1 | 12 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4noc(-c5cccc(OC)c5)n4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955913 | 71161 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 520 | 10 | 1 | 12 | 2.7 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4noc(-c5cccc(OC)c5)n4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 155522786 | 170750 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4452495 | 170750 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 318 | 3 | 2 | 4 | 2.4 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 46227959 | 201726 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 2 | 3 | ChEMBL | 394 | 7 | 0 | 8 | 1.8 | COCCn1c(=O)c2c(nc(Cc3ccccc3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL606535 | 201726 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 2 | 3 | ChEMBL | 394 | 7 | 0 | 8 | 1.8 | COCCn1c(=O)c2c(nc(Cc3ccccc3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 44417680 | 82138 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -870 | 6 | ChEMBL | 344 | 5 | 1 | 6 | 1.6 | CCCn1c(=O)c2nc([C@H]3CC4C[C@@H]3[C@H]3O[C@@H]43)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| CHEMBL216750 | 82138 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -870 | 6 | ChEMBL | 344 | 5 | 1 | 6 | 1.6 | CCCn1c(=O)c2nc([C@H]3CC4C[C@@H]3[C@H]3O[C@@H]43)[nH]c2n(CCC)c1=O | 10.1021/jm0605381 | |||
| 168272084 | 190280 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cccc(N=C=S)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5175698 | 190280 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 369 | 6 | 1 | 7 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cccc(N=C=S)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 1328 | 1368 | None | 35 | Human | Binding | pKi | = | 7.2 | 7.2 | -7 | 4 | ChEMBL | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | 10.1021/jm0104318 | |||
| 445 | 1368 | None | 35 | Human | Binding | pKi | = | 7.2 | 7.2 | -7 | 4 | ChEMBL | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | 10.1021/jm0104318 | |||
| CHEMBL11348 | 1368 | None | 35 | Human | Binding | pKi | = | 7.2 | 7.2 | -7 | 4 | ChEMBL | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | 10.1021/jm0104318 | |||
| 57988794 | 156831 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 340 | 6 | 1 | 7 | 1.2 | C#CCn1cc(-c2nc3c([nH]2)c(=O)n(CCC)c(=O)n3CCC)cn1 | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4071331 | 156831 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 340 | 6 | 1 | 7 | 1.2 | C#CCn1cc(-c2nc3c([nH]2)c(=O)n(CCC)c(=O)n3CCC)cn1 | 10.1016/j.ejmech.2017.04.014 | |||
| 24950690 | 178613 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -9 | 3 | ChEMBL | 275 | 2 | 1 | 4 | 3.8 | Cc1cccc(-c2cc(-c3ccco3)nc(N)c2C#N)c1 | 10.1021/jm701594y | |||
| CHEMBL467386 | 178613 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -9 | 3 | ChEMBL | 275 | 2 | 1 | 4 | 3.8 | Cc1cccc(-c2cc(-c3ccco3)nc(N)c2C#N)c1 | 10.1021/jm701594y | |||
| 11352497 | 122965 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -123 | 4 | ChEMBL | 498 | 8 | 6 | 15 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(O)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| CHEMBL360837 | 122965 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -123 | 4 | ChEMBL | 498 | 8 | 6 | 15 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(N[C@H](CO)Cc5ccc(O)cc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1021/jm031143+ | |||
| 152034 | 76543 | None | 8 | Human | Binding | pKi | = | 5.2 | 5.2 | -1 | 2 | ChEMBL | 278 | 5 | 1 | 5 | 1.6 | CC(C)CCn1c(=O)c2nc[nH]c2n(CC(C)C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL20613 | 76543 | None | 8 | Human | Binding | pKi | = | 5.2 | 5.2 | -1 | 2 | ChEMBL | 278 | 5 | 1 | 5 | 1.6 | CC(C)CCn1c(=O)c2nc[nH]c2n(CC(C)C)c1=O | 10.1021/jm0104318 | |||
| 2732424 | 22190 | None | 29 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1cccs1 | 10.1021/ml400185v | |||
| CHEMBL1322729 | 22190 | None | 29 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 282 | 3 | 2 | 5 | 2.5 | CCOC(=O)C1=C(C)N=C(S)NC1c1cccs1 | 10.1021/ml400185v | |||
| 16070216 | 58013 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 16 | 2 | ChEMBL | 360 | 4 | 1 | 5 | 4.2 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)c1ccc(F)cc1 | 10.1021/ml100249e | |||
| CHEMBL1672617 | 58013 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 16 | 2 | ChEMBL | 360 | 4 | 1 | 5 | 4.2 | O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)c1ccc(F)cc1 | 10.1021/ml100249e | |||
| 44406328 | 134124 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 31 | 3 | ChEMBL | 489 | 9 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccc(OC)cc5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL371649 | 134124 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 31 | 3 | ChEMBL | 489 | 9 | 1 | 10 | 3.3 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccc(OC)cc5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 21874557 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| 5612 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| CHEMBL447664 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| DB06625 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm800961g | |||
| 21874557 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm4011669 | |||
| 5612 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm4011669 | |||
| CHEMBL447664 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm4011669 | |||
| DB06625 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | ChEMBL | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 10.1021/jm4011669 | |||
| 11576751 | 73031 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 7 | 2 | ChEMBL | 488 | 10 | 2 | 7 | 3.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201024 | 73031 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 7 | 2 | ChEMBL | 488 | 10 | 2 | 7 | 3.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C=O)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.2 | 7.2 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.2 | 7.2 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.2 | 7.2 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.2 | 7.2 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/jm0104318 | |||
| 9901497 | 190179 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -162 | 4 | ChEMBL | 317 | 3 | 1 | 8 | 2.0 | N#Cc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL517417 | 190179 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -162 | 4 | ChEMBL | 317 | 3 | 1 | 8 | 2.0 | N#Cc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 70696536 | 75446 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -5 | 2 | ChEMBL | 338 | 5 | 3 | 5 | 2.6 | COc1cccc2cc(C(=O)NCCc3ccc(O)cc3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| CHEMBL2042073 | 75446 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -5 | 2 | ChEMBL | 338 | 5 | 3 | 5 | 2.6 | COc1cccc2cc(C(=O)NCCc3ccc(O)cc3)c(=N)oc12 | 10.1016/j.ejmech.2012.05.009 | |||
| 21874771 | 178562 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -74 | 4 | ChEMBL | 298 | 3 | 1 | 7 | 2.6 | Nc1nc(-c2ccco2)c2nnn(CC3CCCCC3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL467035 | 178562 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -74 | 4 | ChEMBL | 298 | 3 | 1 | 7 | 2.6 | Nc1nc(-c2ccco2)c2nnn(CC3CCCCC3)c2n1 | 10.1021/jm800961g | |||
| 162673363 | 182996 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.6 | CC1=C(C(=O)SC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4793548 | 182996 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 280 | 3 | 2 | 4 | 2.6 | CC1=C(C(=O)SC(C)C)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 25027418 | 64480 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 325 | 4 | 1 | 5 | 3.1 | COc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1OC | 10.1016/j.ejmech.2012.05.033 | |||
| CHEMBL1814067 | 64480 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 325 | 4 | 1 | 5 | 3.1 | COc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1OC | 10.1016/j.ejmech.2012.05.033 | |||
| 67364057 | 74287 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -15 | 3 | ChEMBL | 295 | 2 | 1 | 5 | 2.9 | Cc1cc(-c2nnc(N)nc2-c2ccc(F)cc2)cc(C)n1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL2024116 | 74287 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -15 | 3 | ChEMBL | 295 | 2 | 1 | 5 | 2.9 | Cc1cc(-c2nnc(N)nc2-c2ccc(F)cc2)cc(C)n1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL5076254 | 214421 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 2 | ChEMBL | None | None | None | COc1cc(OC)cc(-c2nc(Nc3ccccc3)nc(-c3ccccc3)c2C#N)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 44588517 | 175157 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 3 | 3 | ChEMBL | 377 | 4 | 2 | 7 | 1.2 | CCCn1c(=O)c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(O)c2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457015 | 175157 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 3 | 3 | ChEMBL | 377 | 4 | 2 | 7 | 1.2 | CCCn1c(=O)c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(O)c2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 22266784 | 141231 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 27 | 2 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5cccc(C(F)(F)F)c5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL382929 | 141231 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 27 | 2 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5cccc(C(F)(F)F)c5)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11698623 | 78182 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 478 | 7 | 1 | 7 | 3.8 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)c(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL210482 | 78182 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 478 | 7 | 1 | 7 | 3.8 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)c(C(F)(F)F)c4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 1676 | 98982 | None | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/jm900413e | |||
| CHEMBL279898 | 98982 | None | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | ChEMBL | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | 10.1021/jm900413e | |||
| 155517938 | 170225 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 334 | 3 | 2 | 4 | 2.9 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4445568 | 170225 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 334 | 3 | 2 | 4 | 2.9 | CC1=C(C(=O)OC(C)C(F)(F)F)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 9901700 | 190890 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -354 | 4 | ChEMBL | 322 | 4 | 1 | 8 | 2.1 | COc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL518497 | 190890 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -354 | 4 | ChEMBL | 322 | 4 | 1 | 8 | 2.1 | COc1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 21958565 | 64457 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5F)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181346 | 64457 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 504 | 9 | 1 | 9 | 4.1 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccccc5F)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 46228017 | 199799 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 400 | 8 | 1 | 8 | 2.5 | CCSCCn1c(=O)c2[nH]c(Cc3ccco3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594046 | 199799 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 400 | 8 | 1 | 8 | 2.5 | CCSCCn1c(=O)c2[nH]c(Cc3ccco3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 10869347 | 203642 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 8 | 4 | ChEMBL | 270 | 3 | 1 | 5 | 0.7 | Cn1c(=O)n(CCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| CHEMBL67228 | 203642 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 8 | 4 | ChEMBL | 270 | 3 | 1 | 5 | 0.7 | Cn1c(=O)n(CCc2ccccc2)c(=O)c2[nH]cnc21 | 10.1021/jm0104318 | |||
| 9967620 | 188975 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -173 | 4 | ChEMBL | 337 | 4 | 1 | 9 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc([N+](=O)[O-])c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL508451 | 188975 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -173 | 4 | ChEMBL | 337 | 4 | 1 | 9 | 2.0 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc([N+](=O)[O-])c3)c2n1 | 10.1021/jm800961g | |||
| 137656644 | 159681 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 304 | 3 | 2 | 5 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4104142 | 159681 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 304 | 3 | 2 | 5 | 2.0 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)N/C(=N/C#N)N1 | 10.1021/acs.jmedchem.7b00138 | |||
| 44281684 | 110412 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 445 | 8 | 2 | 6 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Cc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32447 | 110412 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 445 | 8 | 2 | 6 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Cc4ccccc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11091783 | 84219 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 4 | ChEMBL | 460 | 6 | 2 | 11 | 2.6 | CCNc1c2c(nc(NC(=O)Cc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL22085 | 84219 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 4 | ChEMBL | 460 | 6 | 2 | 11 | 2.6 | CCNc1c2c(nc(NC(=O)Cc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 10659581 | 28803 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -33 | 6 | ChEMBL | 269 | 2 | 1 | 8 | 1.3 | CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL137879 | 28803 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -33 | 6 | ChEMBL | 269 | 2 | 1 | 8 | 1.3 | CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 135874428 | 167560 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 7 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL430044 | 167560 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 7 | 2 | ChEMBL | 479 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4cccc(OC)c4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00564 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00564 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c00564 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.1c01636 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.5b01586 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | = | 7.2 | 7.2 | -34 | 6 | ChEMBL | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11496023 | 138735 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 446 | 7 | 1 | 7 | 3.0 | CCCn1c(=O)c2nc(-c3cnn(Cc4c(F)cc(F)cc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL378020 | 138735 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 446 | 7 | 1 | 7 | 3.0 | CCCn1c(=O)c2nc(-c3cnn(Cc4c(F)cc(F)cc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 155563730 | 175406 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 334 | 3 | 2 | 4 | 2.9 | CC(C)OC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4575695 | 175406 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 334 | 3 | 2 | 4 | 2.9 | CC(C)OC(=O)C1=C(C(F)(F)F)NC(=O)NC1c1ccsc1 | 10.1021/acs.jmedchem.9b01340 | |||
| 44284710 | 100451 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -15 | 2 | ChEMBL | 376 | 6 | 1 | 6 | 3.0 | CCCn1c(=O)c2nc(-c3ccc(Cl)cc3OC)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL290643 | 100451 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -15 | 2 | ChEMBL | 376 | 6 | 1 | 6 | 3.0 | CCCn1c(=O)c2nc(-c3ccc(Cl)cc3OC)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 4675559 | 103853 | None | 5 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL3091714 | 103853 | None | 5 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 4675559 | 103853 | None | 5 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL3091714 | 103853 | None | 5 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 264 | 3 | 1 | 4 | 1.8 | CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| 162663283 | 181962 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 306 | 3 | 2 | 4 | 2.9 | CC1=C(C(=O)OC2CCCC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4780036 | 181962 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 306 | 3 | 2 | 4 | 2.9 | CC1=C(C(=O)OC2CCCC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 135529396 | 116575 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 2 | ChEMBL | 571 | 9 | 2 | 9 | 3.4 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)n(C)n3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| CHEMBL33653 | 116575 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 2 | ChEMBL | 571 | 9 | 2 | 9 | 3.4 | CC(C)Cn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(Br)cc4)n(C)n3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0309654 | |||
| 11590025 | 73413 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 2 | ChEMBL | 429 | 10 | 1 | 8 | 2.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(CC)c(=O)n3CCCOC)cc1 | 10.1021/jm0506221 | |||
| CHEMBL201650 | 73413 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 2 | ChEMBL | 429 | 10 | 1 | 8 | 2.2 | CCOC(=O)COc1ccc(-c2cc3c([nH]2)c(=O)n(CC)c(=O)n3CCCOC)cc1 | 10.1021/jm0506221 | |||
| 145993107 | 166908 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 4 | ChEMBL | 593 | 15 | 1 | 10 | 3.0 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCCC3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4286455 | 166908 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 4 | ChEMBL | 593 | 15 | 1 | 10 | 3.0 | CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCCC3)cc2)n(CCCC)c1=O | 10.1039/C8MD00070K | |||
| 127043663 | 141223 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 3 | ChEMBL | 411 | 7 | 1 | 8 | 2.3 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(CCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3828658 | 141223 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 3 | ChEMBL | 411 | 7 | 1 | 8 | 2.3 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(CCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 162667742 | 182402 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 312 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCc2ccccc2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4785576 | 182402 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 312 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCc2ccccc2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 135409793 | 16470 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -5248 | 4 | ChEMBL | 335 | 5 | 1 | 6 | 3.1 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(N(C)C)cc3)nn12 | 10.1021/jm010570p | |||
| CHEMBL123462 | 16470 | None | 0 | Human | Binding | pKi | = | 5.2 | 5.2 | -5248 | 4 | ChEMBL | 335 | 5 | 1 | 6 | 3.1 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(N(C)C)cc3)nn12 | 10.1021/jm010570p | |||
| 11483771 | 195716 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -19 | 4 | ChEMBL | 312 | 4 | 2 | 5 | 2.4 | Nc1nc(C(=O)NCc2ccccc2F)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL557084 | 195716 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -19 | 4 | ChEMBL | 312 | 4 | 2 | 5 | 2.4 | Nc1nc(C(=O)NCc2ccccc2F)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 71570217 | 86145 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -23 | 4 | ChEMBL | 349 | 5 | 1 | 5 | 3.8 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3)n2)c1 | 10.1016/j.ejmech.2012.11.010 | |||
| CHEMBL2311741 | 86145 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -23 | 4 | ChEMBL | 349 | 5 | 1 | 5 | 3.8 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3)n2)c1 | 10.1016/j.ejmech.2012.11.010 | |||
| 44452536 | 95893 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -16 | 4 | ChEMBL | 309 | 4 | 2 | 7 | 2.3 | CC(O)CNc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| CHEMBL259178 | 95893 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -16 | 4 | ChEMBL | 309 | 4 | 2 | 7 | 2.3 | CC(O)CNc1nc2ccccc2n2nc(-c3ccco3)nc12 | 10.1016/j.bmc.2007.10.103 | |||
| 44588394 | 175347 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -26 | 2 | ChEMBL | 327 | 5 | 1 | 6 | 2.7 | CCCn1c(=O)c2c(cc(-c3ccccc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL457441 | 175347 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -26 | 2 | ChEMBL | 327 | 5 | 1 | 6 | 2.7 | CCCn1c(=O)c2c(cc(-c3ccccc3)n2O)n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 52948671 | 19311 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 5 | 2 | ChEMBL | 520 | 11 | 1 | 5 | 4.8 | COCCCNC(=O)COc1ccc2c(c1)c(CCc1ccccc1)c(-c1ccc(F)cc1F)c(=O)n2C | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290544 | 19311 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 5 | 2 | ChEMBL | 520 | 11 | 1 | 5 | 4.8 | COCCCNC(=O)COc1ccc2c(c1)c(CCc1ccccc1)c(-c1ccc(F)cc1F)c(=O)n2C | 10.1016/j.bmcl.2010.10.030 | |||
| 71680730 | 90208 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -10 | 4 | ChEMBL | 338 | 4 | 1 | 5 | 3.3 | COc1cccc(/C=C/C(=O)Nc2nc3ccccc3c(=O)s2)c1 | 10.1021/jm400336x | |||
| CHEMBL2382431 | 90208 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -10 | 4 | ChEMBL | 338 | 4 | 1 | 5 | 3.3 | COc1cccc(/C=C/C(=O)Nc2nc3ccccc3c(=O)s2)c1 | 10.1021/jm400336x | |||
| 44588393 | 176337 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 10 | 2 | ChEMBL | 349 | 2 | 2 | 7 | 0.3 | Cn1c(=O)c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(O)c2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL459553 | 176337 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 10 | 2 | ChEMBL | 349 | 2 | 2 | 7 | 0.3 | Cn1c(=O)c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)c(O)c2n(C)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 156014270 | 177215 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2cncs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4635502 | 177215 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2cncs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 127038752 | 136743 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -74 | 4 | ChEMBL | 466 | 7 | 4 | 13 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(NC(C)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1039/C5MD00086F | |||
| CHEMBL3740959 | 136743 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -74 | 4 | ChEMBL | 466 | 7 | 4 | 13 | 0.5 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(NC(C)Cc5ccccc5)nc43)[C@H](O)[C@@H]2O)n1 | 10.1039/C5MD00086F | |||
| 10065148 | 99113 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -33 | 4 | ChEMBL | 329 | 4 | 1 | 9 | 2.4 | CCCSc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL280888 | 99113 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -33 | 4 | ChEMBL | 329 | 4 | 1 | 9 | 2.4 | CCCSc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 136383804 | 158094 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 560 | 9 | 1 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4086551 | 158094 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 560 | 9 | 1 | 9 | 3.8 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11537425 | 85380 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 341 | 4 | 1 | 8 | 3.2 | N#Cc1cncc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)c1 | 10.1021/jm061333v | |||
| CHEMBL226237 | 85380 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 341 | 4 | 1 | 8 | 3.2 | N#Cc1cncc(Nc2ncc(-c3ccncn3)c(-c3ccco3)n2)c1 | 10.1021/jm061333v | |||
| 11711753 | 166221 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 15 | 2 | ChEMBL | 434 | 6 | 2 | 7 | 2.3 | COc1cc(OCC(=O)Nc2ccccc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| CHEMBL426660 | 166221 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 15 | 2 | ChEMBL | 434 | 6 | 2 | 7 | 2.3 | COc1cc(OCC(=O)Nc2ccccc2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1021/jm0506221 | |||
| 44451018 | 160584 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 3 | 2 | ChEMBL | 535 | 7 | 1 | 7 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL411275 | 160584 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 3 | 2 | ChEMBL | 535 | 7 | 1 | 7 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5Cl)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 10861697 | 103036 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 2 | 4 | ChEMBL | 374 | 7 | 0 | 6 | 3.1 | CCCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL307105 | 103036 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 2 | 4 | ChEMBL | 374 | 7 | 0 | 6 | 3.1 | CCCn1c(=O)c2c(nc(-c3ccccc3)n2CCCl)n(CCC)c1=O | 10.1021/jm0104318 | |||
| 265603 | 162583 | None | 9 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 301 | 2 | 1 | 7 | 0.5 | Cn1c(=O)c2nc(-c3ccc([N+](=O)[O-])cc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL416884 | 162583 | None | 9 | Human | Binding | pKi | = | 5.2 | 5.2 | - | 1 | ChEMBL | 301 | 2 | 1 | 7 | 0.5 | Cn1c(=O)c2nc(-c3ccc([N+](=O)[O-])cc3)[nH]c2n(C)c1=O | 10.1021/jm0104318 | |||
| 137175186 | 139153 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 290 | 3 | 1 | 7 | 2.2 | CCOC(=O)C1=C(C)Nc2ncnn2C1c1ccsc1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3787179 | 139153 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 290 | 3 | 1 | 7 | 2.2 | CCOC(=O)C1=C(C)Nc2ncnn2C1c1ccsc1 | 10.1021/acs.jmedchem.5b01586 | |||
| 10226014 | 94589 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL252048 | 94589 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1021/acs.jmedchem.5b01586 | |||
| 10226014 | 94589 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL252048 | 94589 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 452 | 6 | 2 | 9 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4noc(-c5ccc(Cl)cc5)n4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 46880333 | 6303 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 29 | 4 | ChEMBL | 279 | 3 | 1 | 4 | 3.4 | CC(=O)Nc1ccc(-c2ccncc2)c(-c2ccco2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1081811 | 6303 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 29 | 4 | ChEMBL | 279 | 3 | 1 | 4 | 3.4 | CC(=O)Nc1ccc(-c2ccncc2)c(-c2ccco2)n1 | 10.1016/j.bmcl.2010.01.045 | |||
| 135678052 | 95775 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| CHEMBL258571 | 95775 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | - | 1 | ChEMBL | 483 | 8 | 2 | 8 | 3.2 | CCCn1c(=O)c2[nH]c(-c3cc(C)n(CC(=O)Nc4ccc(Cl)cc4)n3)nc2n(CCC)c1=O | 10.1016/j.bmc.2007.11.058 | |||
| 145964662 | 164436 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 3 | 3 | ChEMBL | 433 | 8 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4213768 | 164436 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 3 | 3 | ChEMBL | 433 | 8 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 21916389 | 95924 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 4 | 4 | ChEMBL | 394 | 5 | 1 | 7 | 1.9 | Cn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| CHEMBL259300 | 95924 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 4 | 4 | ChEMBL | 394 | 5 | 1 | 7 | 1.9 | Cn1c(=O)n(CC2CC2)c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc21 | 10.1021/jm7014815 | |||
| 49797747 | 10617 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 10 | 3 | ChEMBL | 482 | 6 | 1 | 7 | 3.4 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCOCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170134 | 10617 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 10 | 3 | ChEMBL | 482 | 6 | 1 | 7 | 3.4 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(C(=O)N4CCOCC4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 155551750 | 175386 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 44 | 3 | ChEMBL | 626 | 14 | 2 | 10 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OCCOCCOC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4575279 | 175386 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 44 | 3 | ChEMBL | 626 | 14 | 2 | 10 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OCCOCCOC)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44451271 | 95773 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 45 | 2 | ChEMBL | 542 | 5 | 1 | 8 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5c(Cl)cncc5Cl)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258568 | 95773 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 45 | 2 | ChEMBL | 542 | 5 | 1 | 8 | 2.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5c(Cl)cncc5Cl)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44574194 | 178426 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 2 | 4 | ChEMBL | 460 | 8 | 2 | 6 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL466021 | 178426 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 2 | 4 | ChEMBL | 460 | 8 | 2 | 6 | 4.7 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 155566764 | 175871 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 41 | 2 | ChEMBL | 508 | 6 | 2 | 7 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5)C(C)C4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4586090 | 175871 | None | 0 | Human | Binding | pKi | = | 8.2 | 8.2 | 41 | 2 | ChEMBL | 508 | 6 | 2 | 7 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccccc5)C(C)C4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 44450828 | 157693 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 44 | 2 | ChEMBL | 472 | 6 | 1 | 6 | 3.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL408185 | 157693 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 44 | 2 | ChEMBL | 472 | 6 | 1 | 6 | 3.1 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 44236602 | 159032 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 420 | 5 | 1 | 7 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(F)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4096746 | 159032 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 420 | 5 | 1 | 7 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(F)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44236571 | 155814 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 420 | 5 | 1 | 7 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4059836 | 155814 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 420 | 5 | 1 | 7 | 2.4 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4cccc(F)c4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44451072 | 96038 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 543 | 9 | 1 | 7 | 4.0 | CCCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259874 | 96038 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 543 | 9 | 1 | 7 | 4.0 | CCCn1c(=O)n(CC(C)C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccccc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 44551168 | 201773 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 11 | 3 | ChEMBL | 370 | 5 | 0 | 8 | 2.2 | CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL606753 | 201773 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 11 | 3 | ChEMBL | 370 | 5 | 0 | 8 | 2.2 | CCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 145976828 | 163676 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | 447 | 9 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4204683 | 163676 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | 447 | 9 | 3 | 6 | 2.2 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCc4ccccc4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 44185932 | 191617 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 11 | 4 | ChEMBL | 508 | 7 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL519556 | 191617 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 11 | 4 | ChEMBL | 508 | 7 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 66894103 | 156559 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 569 | 9 | 1 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4068421 | 156559 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 569 | 9 | 1 | 7 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 56951623 | 71171 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 18 | 3 | ChEMBL | 331 | 5 | 2 | 6 | 1.0 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955923 | 71171 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 18 | 3 | ChEMBL | 331 | 5 | 2 | 6 | 1.0 | CCCn1c(=O)c2[nH]c(-c3cc(=O)[nH]n3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44185933 | 186707 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 35 | 5 | ChEMBL | 522 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| CHEMBL488541 | 186707 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 35 | 5 | ChEMBL | 522 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/jm900413e | |||
| 44450850 | 95845 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 9 | 2 | ChEMBL | 598 | 9 | 1 | 8 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5c(Cl)cncc5Cl)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL258979 | 95845 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 9 | 2 | ChEMBL | 598 | 9 | 1 | 8 | 4.4 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5c(Cl)cncc5Cl)CC4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 11498113 | 73027 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 2 | ChEMBL | 607 | 12 | 2 | 8 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CS(=O)(=O)N5CCCC5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201008 | 73027 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 2 | ChEMBL | 607 | 12 | 2 | 8 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(CS(=O)(=O)N5CCCC5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11664137 | 73297 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 4 | 2 | ChEMBL | 565 | 10 | 2 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(N(C=O)CC(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201293 | 73297 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 4 | 2 | ChEMBL | 565 | 10 | 2 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(N(C=O)CC(=O)Nc4ccc(Br)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11604435 | 75023 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 23 | 2 | ChEMBL | 432 | 7 | 2 | 6 | 3.2 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(CC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203413 | 75023 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 23 | 2 | ChEMBL | 432 | 7 | 2 | 6 | 3.2 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(CC)c1=O | 10.1021/jm0506221 | |||
| 137640112 | 156680 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 488 | 8 | 1 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccccc4C(=O)OCC)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4069730 | 156680 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 488 | 8 | 1 | 9 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccccc4C(=O)OCC)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 44574225 | 178591 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 4 | 2 | ChEMBL | 462 | 8 | 2 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cnccn4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL467271 | 178591 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 4 | 2 | ChEMBL | 462 | 8 | 2 | 8 | 3.5 | CCCn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4cnccn4)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 145973326 | 164722 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 29 | 3 | ChEMBL | 729 | 17 | 3 | 7 | 7.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCCCCCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| CHEMBL4217459 | 164722 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 29 | 3 | ChEMBL | 729 | 17 | 3 | 7 | 7.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(OCC(=O)NCCCCCCCCCCC4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.7b01627 | |||
| 11562203 | 73148 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 2 | ChEMBL | 488 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201157 | 73148 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 2 | ChEMBL | 488 | 9 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 44406891 | 73541 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 10 | 2 | ChEMBL | 516 | 9 | 2 | 6 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)(C)C)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201749 | 73541 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 10 | 2 | ChEMBL | 516 | 9 | 2 | 6 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(C)(C)C)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 10720065 | 98395 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 1 | 6 | ChEMBL | 495 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL275427 | 98395 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 1 | 6 | ChEMBL | 495 | 9 | 2 | 7 | 4.0 | CCCn1c(=O)c2nc(-c3ccc(OCC(=O)Nc4ccc(Cl)cc4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 168296088 | 192364 | None | 1 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5207290 | 192364 | None | 1 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 352 | 4 | 2 | 6 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)F)cc3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 11784407 | 97230 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 3 | ChEMBL | 364 | 5 | 3 | 6 | 1.1 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL268617 | 97230 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 3 | ChEMBL | 364 | 5 | 3 | 6 | 1.1 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| CHEMBL36952 | 97230 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 3 | ChEMBL | 364 | 5 | 3 | 6 | 1.1 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm0310030 | |||
| 135465776 | 99718 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 470 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)no3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL284789 | 99718 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 470 | 9 | 2 | 9 | 2.5 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(F)cc4)no3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10647227 | 165452 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL423934 | 165452 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 10647227 | 165452 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL423934 | 165452 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -3 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 52946114 | 19271 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 2 | 2 | ChEMBL | 525 | 9 | 2 | 6 | 5.7 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290325 | 19271 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 2 | 2 | ChEMBL | 525 | 9 | 2 | 6 | 5.7 | CC(C)(NC(=O)COc1ccc2[nH]c(=O)c(-c3nccs3)c(COc3ccccc3)c2c1)c1ccccc1 | 10.1016/j.bmcl.2010.10.030 | |||
| 52945098 | 19351 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 2 | ChEMBL | 504 | 9 | 1 | 6 | 3.4 | Cn1c(=O)c(S(C)(=O)=O)c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccccc3)ccc21 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1290782 | 19351 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -1 | 2 | ChEMBL | 504 | 9 | 1 | 6 | 3.4 | Cn1c(=O)c(S(C)(=O)=O)c(CCc2ccccc2)c2cc(OCC(=O)NCc3ccccc3)ccc21 | 10.1016/j.bmcl.2010.10.030 | |||
| 11784407 | 97230 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 3 | ChEMBL | 364 | 5 | 3 | 6 | 1.1 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL268617 | 97230 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 3 | ChEMBL | 364 | 5 | 3 | 6 | 1.1 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| CHEMBL36952 | 97230 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 6 | 3 | ChEMBL | 364 | 5 | 3 | 6 | 1.1 | CCCCn1c(=O)[nH]c2[nH]c(-c3ccc(S(=O)(=O)O)cc3)nc2c1=O | 10.1021/jm011049y | |||
| 135515507 | 34122 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -4 | 4 | ChEMBL | 394 | 3 | 3 | 7 | 3.6 | O=C(Nc1cccc(Cl)c1)Nc1nc2n[nH]cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL142562 | 34122 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | -4 | 4 | ChEMBL | 394 | 3 | 3 | 7 | 3.6 | O=C(Nc1cccc(Cl)c1)Nc1nc2n[nH]cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 45269769 | 196571 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 7 | 2 | ChEMBL | 404 | 7 | 1 | 6 | 3.3 | CCn1c(=O)c2[nH]c(-c3ccc(-c4ccccc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL563889 | 196571 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 7 | 2 | ChEMBL | 404 | 7 | 1 | 6 | 3.3 | CCn1c(=O)c2[nH]c(-c3ccc(-c4ccccc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11567699 | 73653 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 4 | 2 | ChEMBL | 408 | 6 | 2 | 7 | 1.5 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccco4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201796 | 73653 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 4 | 2 | ChEMBL | 408 | 6 | 2 | 7 | 1.5 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccco4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 44451128 | 161299 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 10 | 2 | ChEMBL | 521 | 5 | 1 | 7 | 3.0 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)N1CCN(c2ccccc2Cl)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL412275 | 161299 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 10 | 2 | ChEMBL | 521 | 5 | 1 | 7 | 3.0 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)N1CCN(c2ccccc2Cl)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 168281755 | 190903 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(OS(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| CHEMBL5185103 | 190903 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | - | 1 | ChEMBL | 368 | 5 | 2 | 7 | 1.1 | CCCn1c(=O)[nH]c2nc(-c3cccc(OS(=O)(=O)F)c3)[nH]c2c1=O | 10.1039/d2md00132b | |||
| 21958702 | 129653 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(C)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL367351 | 129653 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5cccc(C)c5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 11495641 | 139262 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)cc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL379032 | 139262 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 428 | 7 | 1 | 7 | 2.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4ccc(F)cc4F)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 11618368 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| 5611 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| CHEMBL2105747 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| DB12203 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/acs.jmedchem.0c00237 | |||
| 11618368 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/jm4011669 | |||
| 5611 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/jm4011669 | |||
| CHEMBL2105747 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/jm4011669 | |||
| DB12203 | 3845 | None | 77 | Human | Binding | pKi | = | 6.2 | 6.2 | -501 | 5 | ChEMBL | 406 | 3 | 2 | 7 | 2.5 | COc1ccc(c2c1nc(s2)NC(=O)N1CCC(CC1)(C)O)N1CCOCC1 | 10.1021/jm4011669 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.2 | 5.2 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmcl.2004.11.044 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.2 | 5.2 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmcl.2004.11.044 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.2 | 5.2 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.2 | 5.2 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmcl.2004.11.044 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.2 | 5.2 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmcl.2004.11.044 | |||
| 156014687 | 177258 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 323 | 3 | 2 | 6 | 2.6 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]n1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4636116 | 177258 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 323 | 3 | 2 | 6 | 2.6 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cc[nH]n1 | 10.1021/acs.jmedchem.0c00564 | |||
| 456309 | 160650 | None | 17 | Human | Binding | pKi | = | 5.2 | 5.2 | -114 | 4 | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | O[C@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@@H]1CCCCN1 | 10.1021/jm4011669 | |||
| CHEMBL411329 | 160650 | None | 17 | Human | Binding | pKi | = | 5.2 | 5.2 | -114 | 4 | ChEMBL | 378 | 2 | 2 | 3 | 4.4 | O[C@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@@H]1CCCCN1 | 10.1021/jm4011669 | |||
| 156009812 | 177058 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -707 | 2 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2ncco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4632760 | 177058 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -707 | 2 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2ncco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 44588514 | 175065 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 4 | 2 | ChEMBL | 369 | 6 | 2 | 6 | 2.9 | CCCn1c(=O)c2[nH]c(-c3ccc(C(C)=O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL456816 | 175065 | None | 0 | Human | Binding | pKi | = | 7.2 | 7.2 | 4 | 2 | ChEMBL | 369 | 6 | 2 | 6 | 2.9 | CCCn1c(=O)c2[nH]c(-c3ccc(C(C)=O)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 52949999 | 19123 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 572 | 9 | 1 | 5 | 5.1 | CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| CHEMBL1289343 | 19123 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | -1 | 2 | ChEMBL | 572 | 9 | 1 | 5 | 5.1 | CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COc1ccc2[nH]c(=O)c(S(C)(=O)=O)c(CCc3ccccc3)c2c1 | 10.1016/j.bmcl.2010.10.030 | |||
| 156015964 | 177622 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccno1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4641123 | 177622 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccno1 | 10.1021/acs.jmedchem.0c00564 | |||
| 72546298 | 103850 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCOC(=O)C1=C(CC)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| CHEMBL3091710 | 103850 | None | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | - | 1 | ChEMBL | 264 | 4 | 2 | 4 | 1.9 | CCOC(=O)C1=C(CC)NC(=O)NC1c1ccco1 | 10.1021/ml400185v | |||
| 46880473 | 6077 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 19 | 2 | ChEMBL | 305 | 4 | 1 | 5 | 2.7 | O=C(Nc1ccc(-c2ccncc2)c(-n2cccn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1080679 | 6077 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 19 | 2 | ChEMBL | 305 | 4 | 1 | 5 | 2.7 | O=C(Nc1ccc(-c2ccncc2)c(-n2cccn2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 11531449 | 72249 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 12 | 2 | ChEMBL | 401 | 9 | 2 | 7 | 1.7 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(CCCOC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL198191 | 72249 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 12 | 2 | ChEMBL | 401 | 9 | 2 | 7 | 1.7 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc2n(CCCOC)c1=O | 10.1021/jm0506221 | |||
| 44437214 | 169252 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -31 | 6 | ChEMBL | 355 | 3 | 1 | 8 | 0.6 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| CHEMBL441145 | 169252 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -31 | 6 | ChEMBL | 355 | 3 | 1 | 8 | 0.6 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(C)c1=O | 10.1016/j.bmc.2007.07.051 | |||
| 9834769 | 157244 | None | 2 | Human | Binding | pKi | = | 6.1 | 6.1 | -457 | 4 | ChEMBL | 247 | 2 | 0 | 5 | 3.4 | CCc1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| CHEMBL407650 | 157244 | None | 2 | Human | Binding | pKi | = | 6.1 | 6.1 | -457 | 4 | ChEMBL | 247 | 2 | 0 | 5 | 3.4 | CCc1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| 156019063 | 177835 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2ccon2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4644043 | 177835 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 338 | 3 | 1 | 7 | 3.3 | CC1=C(C(=O)OC(C)C)C(c2ccon2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 162667072 | 182407 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 292 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4785646 | 182407 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 292 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CC2)C(c2ccsc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 127030660 | 139028 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 303 | 3 | 1 | 6 | 3.2 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785876 | 139028 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 303 | 3 | 1 | 6 | 3.2 | CC1=C(C(=O)OC(C)C)C(c2cccs2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 22266730 | 94561 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 29 | 2 | ChEMBL | 354 | 4 | 2 | 6 | 1.5 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL251875 | 94561 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 29 | 2 | ChEMBL | 354 | 4 | 2 | 6 | 1.5 | CCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b00138 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b00138 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.7b00138 | |||
| 15667089 | 4615 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -33 | 5 | ChEMBL | 276 | 3 | 1 | 5 | 1.6 | CCn1c(=O)c2nc(C3CCCC3)[nH]c2n(CC)c1=O | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL102859 | 4615 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -33 | 5 | ChEMBL | 276 | 3 | 1 | 5 | 1.6 | CCn1c(=O)c2nc(C3CCCC3)[nH]c2n(CC)c1=O | 10.1021/acs.jmedchem.9b01340 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c00564 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c00564 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c00564 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.1c01636 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.1c01636 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.1c01636 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.1c01636 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.5b01586 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.5b01586 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL5074986 | 214346 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -15 | 3 | ChEMBL | None | None | None | N#Cc1c(-c2cccc(Cl)c2)nc(N)nc1-c1cccc(Cl)c1 | 10.1021/acs.jmedchem.1c01636 | |||||
| 155542822 | 173165 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4521818 | 173165 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 377 | 3 | 1 | 6 | 4.0 | CCOC(=O)C1=C(C(F)(F)F)Nc2nc3ccccc3n2C1c1ccco1 | 10.1021/acs.jmedchem.9b01340 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 5.1 | 5.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c01431 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 5.1 | 5.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 5.1 | 5.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c01431 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 5.1 | 5.1 | -1288 | 14 | ChEMBL | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 10.1021/acs.jmedchem.0c01431 | |||
| 162671640 | 182853 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 290 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CCC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4791578 | 182853 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 290 | 4 | 2 | 4 | 2.3 | CC1=C(C(=O)OCC2CCC2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 135421366 | 108965 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 13 | 2 | ChEMBL | 521 | 11 | 2 | 9 | 3.6 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C(C)CC)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32118 | 108965 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 13 | 2 | ChEMBL | 521 | 11 | 2 | 9 | 3.6 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C(C)CC)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 44406592 | 72870 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 4 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5C(F)(F)F)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200313 | 72870 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 4 | 3 | ChEMBL | 528 | 8 | 1 | 10 | 3.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5C(F)(F)F)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11711190 | 77789 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -4 | 3 | ChEMBL | 406 | 8 | 1 | 7 | 2.8 | CCCn1c(=O)c2nc(-c3cnn(CCc4ccccc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL209217 | 77789 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -4 | 3 | ChEMBL | 406 | 8 | 1 | 7 | 2.8 | CCCn1c(=O)c2nc(-c3cnn(CCc4ccccc4)c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 21874581 | 169613 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -138 | 4 | ChEMBL | 322 | 4 | 1 | 8 | 2.1 | COc1ccccc1Cn1nnc2c(-c3ccco3)nc(N)nc21 | 10.1021/jm800961g | |||
| CHEMBL443665 | 169613 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -138 | 4 | ChEMBL | 322 | 4 | 1 | 8 | 2.1 | COc1ccccc1Cn1nnc2c(-c3ccco3)nc(N)nc21 | 10.1021/jm800961g | |||
| 9497523 | 181357 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -53 | 3 | ChEMBL | 267 | 2 | 1 | 5 | 3.5 | N#Cc1c(-c2cccs2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| CHEMBL476311 | 181357 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -53 | 3 | ChEMBL | 267 | 2 | 1 | 5 | 3.5 | N#Cc1c(-c2cccs2)cc(-c2ccco2)nc1N | 10.1021/jm701594y | |||
| 156020575 | 178063 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2nccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4647365 | 178063 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 354 | 3 | 1 | 7 | 3.7 | CC1=C(C(=O)OC(C)C)C(c2nccs2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.0c00564 | |||
| 11426423 | 195099 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -177 | 4 | ChEMBL | 295 | 4 | 2 | 6 | 1.6 | Nc1nc(C(=O)NCc2ccccn2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL549885 | 195099 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -177 | 4 | ChEMBL | 295 | 4 | 2 | 6 | 1.6 | Nc1nc(C(=O)NCc2ccccn2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 11850015 | 80158 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -72 | 2 | ChEMBL | 367 | 3 | 0 | 6 | 3.5 | Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(-c4ccccc4)cc3c12 | 10.1016/j.bmc.2010.09.043 | |||
| CHEMBL213425 | 80158 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -72 | 2 | ChEMBL | 367 | 3 | 0 | 6 | 3.5 | Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(-c4ccccc4)cc3c12 | 10.1016/j.bmc.2010.09.043 | |||
| 19074239 | 203854 | None | 6 | Human | Binding | pKi | = | 5.1 | 5.1 | -6 | 2 | ChEMBL | 320 | 10 | 1 | 5 | 3.0 | CCCCCCn1c(=O)c2nc[nH]c2n(CCCCCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL68660 | 203854 | None | 6 | Human | Binding | pKi | = | 5.1 | 5.1 | -6 | 2 | ChEMBL | 320 | 10 | 1 | 5 | 3.0 | CCCCCCn1c(=O)c2nc[nH]c2n(CCCCCC)c1=O | 10.1021/jm0104318 | |||
| 135522362 | 100019 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286838 | 100019 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135522362 | 100019 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286838 | 100019 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 472 | 8 | 1 | 10 | 0.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(C)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10895416 | 57183 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -7 | 4 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL164905 | 57183 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -7 | 4 | ChEMBL | 436 | 5 | 2 | 8 | 4.4 | CCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 136042345 | 71169 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 585 | 8 | 2 | 9 | 4.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955921 | 71169 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 585 | 8 | 2 | 9 | 4.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(C(F)(F)F)cc(C(F)(F)F)cc5[nH]4)no3)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 11438116 | 84665 | None | 4 | Human | Binding | pKi | = | 7.1 | 7.1 | -5 | 4 | ChEMBL | 303 | 4 | 1 | 3 | 4.2 | CCC(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1 | 10.1021/jm100843z | |||
| CHEMBL222474 | 84665 | None | 4 | Human | Binding | pKi | = | 7.1 | 7.1 | -5 | 4 | ChEMBL | 303 | 4 | 1 | 3 | 4.2 | CCC(=O)Nc1cc(-c2ccccc2)nc(-c2ccccc2)n1 | 10.1021/jm100843z | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1021/jm031143+ | |||
| 44410550 | 76258 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -5888 | 4 | ChEMBL | 511 | 7 | 5 | 12 | 0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccccc4[N+](=O)[O-])nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL205850 | 76258 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -5888 | 4 | ChEMBL | 511 | 7 | 5 | 12 | 0.0 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)c4ccccc4[N+](=O)[O-])nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 156019196 | 177951 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -389 | 2 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncco1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4645754 | 177951 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -389 | 2 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ncco1 | 10.1021/acs.jmedchem.0c00564 | |||
| 66892978 | 159226 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 519 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(=O)O)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4098853 | 159226 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 519 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C(=O)O)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 45269706 | 196070 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 2 | ChEMBL | 469 | 10 | 2 | 8 | 2.0 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCCC4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL560623 | 196070 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 2 | ChEMBL | 469 | 10 | 2 | 8 | 2.0 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCCC4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 11555937 | 140420 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 564 | 11 | 2 | 7 | 5.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)c5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL380901 | 140420 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 564 | 11 | 2 | 7 | 5.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C(=O)c5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 135416050 | 100104 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 494 | 9 | 2 | 10 | 2.2 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc([N+](=O)[O-])cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL287493 | 100104 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 494 | 9 | 2 | 10 | 2.2 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc([N+](=O)[O-])cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135529373 | 112365 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 24 | 2 | ChEMBL | 485 | 8 | 2 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(F)c(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32950 | 112365 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 24 | 2 | ChEMBL | 485 | 8 | 2 | 8 | 2.6 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(F)c(F)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10994183 | 120230 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -154 | 4 | ChEMBL | 460 | 6 | 2 | 10 | 3.9 | CCCCn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL352192 | 120230 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -154 | 4 | ChEMBL | 460 | 6 | 2 | 10 | 3.9 | CCCCn1cc2c(nc(NC(=O)Nc3ccc4c(c3)OCO4)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 11091632 | 119957 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -2 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL349716 | 119957 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -2 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 46880421 | 6371 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 4 | 4 | ChEMBL | 322 | 4 | 1 | 5 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2cncs2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| CHEMBL1082171 | 6371 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 4 | 4 | ChEMBL | 322 | 4 | 1 | 5 | 3.6 | O=C(Nc1ccc(-c2ccncc2)c(-c2cncs2)n1)C1CC1 | 10.1016/j.bmcl.2010.01.045 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm900413e | |||
| 156018198 | 177829 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccon1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4643944 | 177829 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccon1 | 10.1021/acs.jmedchem.0c00564 | |||
| 137645670 | 157997 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 424 | 6 | 2 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CC4(O)CCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4085353 | 157997 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 424 | 6 | 2 | 8 | 1.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CC4(O)CCCC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 21874603 | 178584 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -34 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(F)c3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL467244 | 178584 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -34 | 4 | ChEMBL | 328 | 3 | 1 | 7 | 2.4 | Nc1nc(-c2ccco2)c2nnn(Cc3cccc(F)c3F)c2n1 | 10.1021/jm800961g | |||
| 11561747 | 73088 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 6 | 2 | ChEMBL | 463 | 8 | 2 | 6 | 3.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)c(Br)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201108 | 73088 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 6 | 2 | ChEMBL | 463 | 8 | 2 | 6 | 3.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)c(Br)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11524078 | 73540 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 8 | 2 | ChEMBL | 396 | 5 | 2 | 6 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCCC4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201745 | 73540 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 8 | 2 | ChEMBL | 396 | 5 | 2 | 6 | 1.7 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NC4CCCC4)cc3)cc2n(C)c1=O | 10.1021/jm0506221 | |||
| 155525396 | 171088 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -7 | 4 | ChEMBL | 295 | 2 | 2 | 5 | 2.7 | Oc1ccc(-c2nc(N3CCCCC3)c3nc[nH]c3n2)cc1 | 10.1016/j.bmc.2019.06.034 | |||
| CHEMBL4457537 | 171088 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -7 | 4 | ChEMBL | 295 | 2 | 2 | 5 | 2.7 | Oc1ccc(-c2nc(N3CCCCC3)c3nc[nH]c3n2)cc1 | 10.1016/j.bmc.2019.06.034 | |||
| 46837703 | 10591 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 458 | 6 | 2 | 5 | 3.1 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1169972 | 10591 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 458 | 6 | 2 | 5 | 3.1 | CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc21 | 10.1016/j.ejmech.2010.03.011 | |||
| 14000474 | 50998 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 314 | 5 | 1 | 7 | 1.2 | CCCn1c(=O)c2nc(-c3cnccn3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| CHEMBL157836 | 50998 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 314 | 5 | 1 | 7 | 1.2 | CCCn1c(=O)c2nc(-c3cnccn3)[nH]c2n(CCC)c1=O | 10.1021/jm0104318 | |||
| 44410697 | 77283 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -4265 | 4 | ChEMBL | 458 | 6 | 5 | 10 | -0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)C4CCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL208160 | 77283 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -4265 | 4 | ChEMBL | 458 | 6 | 5 | 10 | -0.1 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)C4CCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 44520982 | 199846 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -794 | 4 | ChEMBL | 298 | 4 | 3 | 6 | 1.3 | Cc1ccc(-c2cc(C(=O)NCc3ncc[nH]3)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| CHEMBL594363 | 199846 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -794 | 4 | ChEMBL | 298 | 4 | 3 | 6 | 1.3 | Cc1ccc(-c2cc(C(=O)NCc3ncc[nH]3)nc(N)n2)o1 | 10.1016/j.bmc.2009.07.078 | |||
| 69030489 | 159444 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 489 | 8 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4101208 | 159444 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 489 | 8 | 1 | 8 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(C)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 10158974 | 155504 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | -1 | 3 | ChEMBL | 418 | 5 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| CHEMBL404168 | 155504 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | -1 | 3 | ChEMBL | 418 | 5 | 2 | 6 | 2.8 | CCCn1c(=O)[nH]c2nc(-c3cnn(Cc4cccc(C(F)(F)F)c4)c3)[nH]c2c1=O | 10.1016/j.bmcl.2008.01.008 | |||
| 11952670 | 6334 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 44 | 3 | ChEMBL | 278 | 2 | 2 | 6 | 2.3 | Nc1n[nH]c2nc(-c3ccco3)c(-c3ccncn3)cc12 | 10.1016/j.bmcl.2010.01.077 | |||
| CHEMBL1082001 | 6334 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 44 | 3 | ChEMBL | 278 | 2 | 2 | 6 | 2.3 | Nc1n[nH]c2nc(-c3ccco3)c(-c3ccncn3)cc12 | 10.1016/j.bmcl.2010.01.077 | |||
| 46911060 | 10646 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 4 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| CHEMBL1170367 | 10646 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 4 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2011.02.053 | |||
| 46911060 | 10646 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 4 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1170367 | 10646 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 6 | 4 | ChEMBL | 373 | 5 | 1 | 7 | 2.7 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccnn3C)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 49797771 | 10853 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 9 | 3 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4ccnc4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| CHEMBL1172275 | 10853 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 9 | 3 | ChEMBL | 435 | 6 | 1 | 7 | 4.1 | CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(-n4ccnc4)cc3)sc12 | 10.1016/j.bmcl.2010.05.056 | |||
| 156012446 | 177334 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cocn1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4637285 | 177334 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 324 | 3 | 1 | 7 | 2.9 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cocn1 | 10.1021/acs.jmedchem.0c00564 | |||
| 136042353 | 71151 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 70 | 2 | ChEMBL | 530 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955902 | 71151 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 70 | 2 | ChEMBL | 530 | 8 | 2 | 9 | 3.6 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(F)(F)F)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44451269 | 96264 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 33 | 2 | ChEMBL | 565 | 5 | 1 | 7 | 3.1 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)N1CCN(c2ccc(Br)cc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL261068 | 96264 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 33 | 2 | ChEMBL | 565 | 5 | 1 | 7 | 3.1 | CC(Oc1ccc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1)C(=O)N1CCN(c2ccc(Br)cc2)CC1 | 10.1016/j.bmc.2008.01.002 | |||
| 11270783 | 1225 | None | 35 | Human | Binding | pKi | = | 8.1 | 8.1 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm201292w | |||
| 5615 | 1225 | None | 35 | Human | Binding | pKi | = | 8.1 | 8.1 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm201292w | |||
| CHEMBL260933 | 1225 | None | 35 | Human | Binding | pKi | = | 8.1 | 8.1 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm201292w | |||
| DB05936 | 1225 | None | 35 | Human | Binding | pKi | = | 8.1 | 8.1 | 67 | 4 | ChEMBL | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 10.1021/jm201292w | |||
| 155565911 | 175775 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 522 | 7 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(C(C)c5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4583860 | 175775 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 522 | 7 | 2 | 7 | 2.6 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(C(C)c5ccccc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 155548264 | 173766 | None | 0 | Mouse | Binding | pKi | = | 8.1 | 8.1 | -4 | 3 | ChEMBL | 542 | 6 | 1 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)nc2n(C)c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4537196 | 173766 | None | 0 | Mouse | Binding | pKi | = | 8.1 | 8.1 | -4 | 3 | ChEMBL | 542 | 6 | 1 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)nc2n(C)c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 66894029 | 158132 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 570 | 9 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4087139 | 158132 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 570 | 9 | 1 | 8 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(C(F)(F)F)c5)C4)nc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 44450829 | 95875 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 41 | 4 | ChEMBL | 444 | 4 | 1 | 6 | 2.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259105 | 95875 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 41 | 4 | ChEMBL | 444 | 4 | 1 | 6 | 2.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 154701278 | 169903 | None | 1 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@@H](C)C(F)(F)F)[C@@H](c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| CHEMBL4440908 | 169903 | None | 1 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 391 | 3 | 1 | 6 | 4.4 | CC1=C(C(=O)O[C@@H](C)C(F)(F)F)[C@@H](c2ccco2)n2c(nc3ccccc32)N1 | 10.1021/acs.jmedchem.9b01340 | |||
| 11313397 | 174707 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 18 | 2 | ChEMBL | 326 | 5 | 2 | 5 | 2.6 | CCCn1c(=O)c2[nH]c(-c3ccc(N)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL455986 | 174707 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 18 | 2 | ChEMBL | 326 | 5 | 2 | 5 | 2.6 | CCCn1c(=O)c2[nH]c(-c3ccc(N)cc3)cc2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 11677816 | 73117 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | 506 | 9 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201128 | 73117 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 1 | 2 | ChEMBL | 506 | 9 | 2 | 6 | 4.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)Nc4ccc(F)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11541413 | 138489 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 2 | 2 | ChEMBL | 566 | 12 | 2 | 7 | 5.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OCc5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL377485 | 138489 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 2 | 2 | ChEMBL | 566 | 12 | 2 | 7 | 5.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(OCc5ccccc5)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 54768602 | 80997 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -2 | 3 | ChEMBL | 331 | 1 | 0 | 7 | 1.4 | Cn1c(=O)c2c(nc3n2CCN3C2CCCCCCC2)n(C)c1=O | 10.1016/j.ejmech.2011.05.023 | |||
| CHEMBL2153629 | 80997 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -2 | 3 | ChEMBL | 331 | 1 | 0 | 7 | 1.4 | Cn1c(=O)c2c(nc3n2CCN3C2CCCCCCC2)n(C)c1=O | 10.1016/j.ejmech.2011.05.023 | |||
| 162664296 | 182078 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 259 | 2 | 2 | 4 | 2.4 | CC1=C(c2ncc(C)o2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4781559 | 182078 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 259 | 2 | 2 | 4 | 2.4 | CC1=C(c2ncc(C)o2)C(c2ccoc2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 71683094 | 90207 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | 2 | 2 | ChEMBL | 328 | 4 | 1 | 4 | 3.4 | O=C(CCc1ccccc1F)Nc1nc2ccccc2c(=O)s1 | 10.1021/jm400336x | |||
| CHEMBL2382428 | 90207 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | 2 | 2 | ChEMBL | 328 | 4 | 1 | 4 | 3.4 | O=C(CCc1ccccc1F)Nc1nc2ccccc2c(=O)s1 | 10.1021/jm400336x | |||
| 10505816 | 30352 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -3 | 5 | ChEMBL | 508 | 8 | 2 | 9 | 5.0 | COc1ccc(NC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL139182 | 30352 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -3 | 5 | ChEMBL | 508 | 8 | 2 | 9 | 5.0 | COc1ccc(NC(=O)Nc2nc3nn(CCCc4ccccc4)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 162673763 | 183075 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 248 | 4 | 2 | 3 | 2.3 | CCCC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4794386 | 183075 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 248 | 4 | 2 | 3 | 2.3 | CCCC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 135522364 | 99907 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 17 | 2 | ChEMBL | 480 | 8 | 3 | 9 | 2.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4ccc(OC)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286102 | 99907 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 17 | 2 | ChEMBL | 480 | 8 | 3 | 9 | 2.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4ccc(OC)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 10859484 | 77656 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -5 | 4 | ChEMBL | 298 | 3 | 2 | 9 | 1.3 | CCNc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL20888 | 77656 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -5 | 4 | ChEMBL | 298 | 3 | 2 | 9 | 1.3 | CCNc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| CHEMBL544678 | 77656 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -5 | 4 | ChEMBL | 298 | 3 | 2 | 9 | 1.3 | CCNc1c2c(nc(N)n3nc(-c4ccco4)nc23)nn1C | 10.1021/jm021023m | |||
| 9868991 | 118987 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 4 | ChEMBL | 462 | 5 | 2 | 8 | 5.0 | CC(C)=CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL342500 | 118987 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 4 | ChEMBL | 462 | 5 | 2 | 8 | 5.0 | CC(C)=CCn1cc2c(nc(NC(=O)Nc3cccc(Cl)c3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 10791347 | 165162 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -7 | 6 | ChEMBL | 494 | 7 | 2 | 9 | 4.6 | COc1ccc(NC(=O)Nc2nc3nn(CCc4ccccc4)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| CHEMBL422820 | 165162 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -7 | 6 | ChEMBL | 494 | 7 | 2 | 9 | 4.6 | COc1ccc(NC(=O)Nc2nc3nn(CCc4ccccc4)cc3c3nc(-c4ccco4)nn23)cc1 | 10.1021/jm001047y | |||
| 44574167 | 178704 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 6 | 2 | ChEMBL | 405 | 4 | 2 | 7 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL468296 | 178704 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 6 | 2 | ChEMBL | 405 | 4 | 2 | 7 | 2.4 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccccn4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 12295530 | 99775 | None | 15 | Human | Binding | pKi | = | 6.1 | 6.1 | 3 | 3 | ChEMBL | 228 | 1 | 3 | 3 | 0.6 | O=c1[nH]c(=O)c2[nH]c(-c3ccccc3)nc2[nH]1 | 10.1021/jm011049y | |||
| CHEMBL285191 | 99775 | None | 15 | Human | Binding | pKi | = | 6.1 | 6.1 | 3 | 3 | ChEMBL | 228 | 1 | 3 | 3 | 0.6 | O=c1[nH]c(=O)c2[nH]c(-c3ccccc3)nc2[nH]1 | 10.1021/jm011049y | |||
| 45486932 | 197014 | None | 3 | Human | Binding | pKi | = | 5.1 | 5.1 | -6 | 3 | ChEMBL | 267 | 5 | 1 | 5 | 2.5 | CCn1cnc2c(NCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| CHEMBL567012 | 197014 | None | 3 | Human | Binding | pKi | = | 5.1 | 5.1 | -6 | 3 | ChEMBL | 267 | 5 | 1 | 5 | 2.5 | CCn1cnc2c(NCCc3ccccc3)ncnc21 | 10.1039/C5MD00034C | |||
| 137175187 | 138964 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 304 | 3 | 1 | 7 | 2.6 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2ncnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785256 | 138964 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 304 | 3 | 1 | 7 | 2.6 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2ncnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 44406555 | 72861 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 5 | 4 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5OC)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL200278 | 72861 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 5 | 4 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5ccccc5OC)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 44406562 | 134200 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 7 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(OC)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL371676 | 134200 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 7 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4nc(-c5cccc(OC)c5)no4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 22266738 | 166282 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 6 | 4 | ChEMBL | 493 | 8 | 1 | 9 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccc(Cl)cc5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL427016 | 166282 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 6 | 4 | ChEMBL | 493 | 8 | 1 | 9 | 3.9 | CCCn1c(=O)c2nc(-c3cnn(Cc4cc(-c5ccc(Cl)cc5)on4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 5353365 | 1209 | None | 32 | Human | Binding | pKi | = | 5.1 | 5.1 | -263 | 6 | ChEMBL | 330 | 2 | 0 | 6 | 1.8 | Clc1cccc(c1)/C=C/c1nc2c(n1C)c(=O)n(c(=O)n2C)C | 10.1021/jm400336x | |||
| 5609 | 1209 | None | 32 | Human | Binding | pKi | = | 5.1 | 5.1 | -263 | 6 | ChEMBL | 330 | 2 | 0 | 6 | 1.8 | Clc1cccc(c1)/C=C/c1nc2c(n1C)c(=O)n(c(=O)n2C)C | 10.1021/jm400336x | |||
| CHEMBL26138 | 1209 | None | 32 | Human | Binding | pKi | = | 5.1 | 5.1 | -263 | 6 | ChEMBL | 330 | 2 | 0 | 6 | 1.8 | Clc1cccc(c1)/C=C/c1nc2c(n1C)c(=O)n(c(=O)n2C)C | 10.1021/jm400336x | |||
| 44236417 | 158690 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 452 | 7 | 1 | 9 | 0.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCN(C)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4093116 | 158690 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 452 | 7 | 1 | 9 | 0.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#CCN4CCN(C)CC4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 21958814 | 135642 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 11 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccccc5OC)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| CHEMBL372951 | 135642 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 11 | 3 | ChEMBL | 490 | 9 | 1 | 11 | 2.7 | CCCn1c(=O)c2nc(-c3cnn(Cc4noc(-c5ccccc5OC)n4)c3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2005.10.002 | |||
| 11706151 | 72034 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -1 | 2 | ChEMBL | 508 | 10 | 2 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccccc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL197605 | 72034 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -1 | 2 | ChEMBL | 508 | 10 | 2 | 6 | 4.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCc4ccccc4)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 11519361 | 75010 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 3 | 2 | ChEMBL | 528 | 9 | 2 | 6 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4Cl)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL203359 | 75010 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 3 | 2 | ChEMBL | 528 | 9 | 2 | 6 | 5.3 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4Cl)cc3)c(Cl)c2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 46228016 | 201865 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -2 | 2 | ChEMBL | 410 | 8 | 1 | 7 | 2.9 | CCSCCn1c(=O)c2[nH]c(Cc3ccccc3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL607258 | 201865 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -2 | 2 | ChEMBL | 410 | 8 | 1 | 7 | 2.9 | CCSCCn1c(=O)c2[nH]c(Cc3ccccc3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 12150 | 2331 | None | 2 | Human | Binding | pKi | = | 6.1 | 6.1 | -100 | 4 | ChEMBL | 399 | 4 | 3 | 9 | 1.9 | O[C@H]1[C@@H](O)[C@H](n2c3nc(C#CCCCC)nc(N)c3nc2c2cccs2)OC1 | 10.1021/acs.jmedchem.2c00462 | |||
| 164885960 | 2331 | None | 2 | Human | Binding | pKi | = | 6.1 | 6.1 | -100 | 4 | ChEMBL | 399 | 4 | 3 | 9 | 1.9 | O[C@H]1[C@@H](O)[C@H](n2c3nc(C#CCCCC)nc(N)c3nc2c2cccs2)OC1 | 10.1021/acs.jmedchem.2c00462 | |||
| CHEMBL5203469 | 2331 | None | 2 | Human | Binding | pKi | = | 6.1 | 6.1 | -100 | 4 | ChEMBL | 399 | 4 | 3 | 9 | 1.9 | O[C@H]1[C@@H](O)[C@H](n2c3nc(C#CCCCC)nc(N)c3nc2c2cccs2)OC1 | 10.1021/acs.jmedchem.2c00462 | |||
| 25188209 | 178757 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -20 | 4 | ChEMBL | 311 | 3 | 1 | 8 | 1.6 | Nc1nc(-c2ncco2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| CHEMBL468701 | 178757 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -20 | 4 | ChEMBL | 311 | 3 | 1 | 8 | 1.6 | Nc1nc(-c2ncco2)c2nnn(Cc3ccccc3F)c2n1 | 10.1021/jm800961g | |||
| 135543600 | 16328 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -933 | 4 | ChEMBL | 336 | 6 | 1 | 6 | 3.4 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(OCC)cc3)nn12 | 10.1021/jm010570p | |||
| CHEMBL122819 | 16328 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -933 | 4 | ChEMBL | 336 | 6 | 1 | 6 | 3.4 | CCCCc1nc2[nH]cnc2c2nc(-c3ccc(OCC)cc3)nn12 | 10.1021/jm010570p | |||
| 21874641 | 189855 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -52 | 4 | ChEMBL | 323 | 3 | 3 | 9 | 1.4 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(O)c3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL516770 | 189855 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -52 | 4 | ChEMBL | 323 | 3 | 3 | 9 | 1.4 | Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(O)c3)c2n1 | 10.1021/jm800961g | |||
| 2748297 | 181700 | None | 12 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 278 | 4 | 2 | 4 | 2.2 | CCC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4776764 | 181700 | None | 12 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 278 | 4 | 2 | 4 | 2.2 | CCC(C)OC(=O)C1=C(C)NC(=O)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 127030064 | 138974 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 303 | 3 | 1 | 6 | 3.2 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785334 | 138974 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 303 | 3 | 1 | 6 | 3.2 | CC1=C(C(=O)OC(C)C)C(c2ccsc2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 44410691 | 138185 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -15848 | 4 | ChEMBL | 460 | 9 | 5 | 10 | 0.3 | CCCCC[C@H](O)C#Cc1nc(NCC)c2ncn([C@@H]3O[C@H](C(=O)NCC)[C@@H](O)[C@H]3O)c2n1 | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL376968 | 138185 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -15848 | 4 | ChEMBL | 460 | 9 | 5 | 10 | 0.3 | CCCCC[C@H](O)C#Cc1nc(NCC)c2ncn([C@@H]3O[C@H](C(=O)NCC)[C@@H](O)[C@H]3O)c2n1 | 10.1016/j.bmcl.2006.01.110 | |||
| 135430228 | 110316 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 9 | 2 | ChEMBL | 548 | 10 | 1 | 10 | 1.8 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(Cc5ccccc5)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32388 | 110316 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 9 | 2 | ChEMBL | 548 | 10 | 1 | 10 | 1.8 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)N4CCN(Cc5ccccc5)CC4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11122708 | 120212 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -13 | 4 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL352073 | 120212 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -13 | 4 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 16071781 | 58024 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 351 | 4 | 1 | 5 | 3.6 | O=C(Nc1cnc(-c2ccncc2Cl)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| CHEMBL1672628 | 58024 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 351 | 4 | 1 | 5 | 3.6 | O=C(Nc1cnc(-c2ccncc2Cl)c(-c2cccnc2)n1)C1CC1 | 10.1021/ml100249e | |||
| 45268921 | 196113 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | 317 | 6 | 2 | 6 | 0.9 | CCn1c(=O)c2[nH]c(-c3ccc[nH]3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL560967 | 196113 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | 317 | 6 | 2 | 6 | 0.9 | CCn1c(=O)c2[nH]c(-c3ccc[nH]3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 127034214 | 138978 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 287 | 3 | 1 | 6 | 2.7 | CC1=C(C(=O)OC(C)C)C(c2ccco2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL3785381 | 138978 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 287 | 3 | 1 | 6 | 2.7 | CC1=C(C(=O)OC(C)C)C(c2ccco2)n2ccnc2N1 | 10.1021/acs.jmedchem.5b01586 | |||
| 12654835 | 56755 | None | 2 | Human | Binding | pKi | = | 5.1 | 5.1 | - | 1 | ChEMBL | 265 | 2 | 1 | 3 | 3.0 | O=C(Nc1ccccc1)c1coc2ccccc2c1=O | 10.1016/j.ejmech.2012.05.033 | |||
| CHEMBL1643120 | 56755 | None | 2 | Human | Binding | pKi | = | 5.1 | 5.1 | - | 1 | ChEMBL | 265 | 2 | 1 | 3 | 3.0 | O=C(Nc1ccccc1)c1coc2ccccc2c1=O | 10.1016/j.ejmech.2012.05.033 | |||
| 127043668 | 141169 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 524 | 11 | 0 | 10 | 2.3 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN3CCOCC3)cc2)n(CCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| CHEMBL3827920 | 141169 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 524 | 11 | 0 | 10 | 2.3 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN3CCOCC3)cc2)n(CCC)c1=O | 10.1016/j.bmc.2016.07.028 | |||
| 45267987 | 194787 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -112 | 4 | ChEMBL | 294 | 4 | 2 | 5 | 2.2 | Nc1nc(C(=O)NCc2ccccc2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL538629 | 194787 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -112 | 4 | ChEMBL | 294 | 4 | 2 | 5 | 2.2 | Nc1nc(C(=O)NCc2ccccc2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 44442019 | 154312 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -269 | 3 | ChEMBL | 618 | 8 | 6 | 11 | 3.5 | CC(C)(C)c1cc(C(=O)NCCc2ccc(Nc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)cc(C(C)(C)C)c1O | 10.1016/j.bmcl.2007.07.035 | |||
| CHEMBL398669 | 154312 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -269 | 3 | ChEMBL | 618 | 8 | 6 | 11 | 3.5 | CC(C)(C)c1cc(C(=O)NCCc2ccc(Nc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)cc(C(C)(C)C)c1O | 10.1016/j.bmcl.2007.07.035 | |||
| 135448286 | 109709 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 507 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C(C)=O)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32288 | 109709 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 507 | 10 | 2 | 10 | 2.3 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(C(C)=O)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135522390 | 119139 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 550 | 10 | 2 | 11 | 2.0 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(N5CCOCC5)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL34281 | 119139 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 550 | 10 | 2 | 11 | 2.0 | CCCn1c(=O)c2nc(-c3cc(OCC(=O)Nc4ccc(N5CCOCC5)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 145993331 | 166917 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -1 | 4 | ChEMBL | 576 | 14 | 1 | 11 | 2.4 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCn3ccnc3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4286634 | 166917 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -1 | 4 | ChEMBL | 576 | 14 | 1 | 11 | 2.4 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCn3ccnc3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 9860013 | 156981 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -616 | 4 | ChEMBL | 261 | 2 | 0 | 5 | 3.9 | CC(C)c1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| CHEMBL407307 | 156981 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -616 | 4 | ChEMBL | 261 | 2 | 0 | 5 | 3.9 | CC(C)c1nc(-c2nccs2)c2sccc2n1 | 10.1016/j.bmcl.2008.03.076 | |||
| 9860013 | 156981 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -616 | 4 | ChEMBL | 261 | 2 | 0 | 5 | 3.9 | CC(C)c1nc(-c2nccs2)c2sccc2n1 | 10.1021/jm4011669 | |||
| CHEMBL407307 | 156981 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -616 | 4 | ChEMBL | 261 | 2 | 0 | 5 | 3.9 | CC(C)c1nc(-c2nccs2)c2sccc2n1 | 10.1021/jm4011669 | |||
| 11037739 | 165542 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -6 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL424161 | 165542 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -6 | 4 | ChEMBL | 450 | 6 | 2 | 8 | 4.8 | CCCCn1cc2c(nc(NC(=O)Nc3ccc(Cl)cc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 136042348 | 71174 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -1 | 2 | ChEMBL | 508 | 9 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc5c(c4)OCO5)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955926 | 71174 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -1 | 2 | ChEMBL | 508 | 9 | 2 | 10 | 2.5 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc5c(c4)OCO5)nn3C)cc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44308015 | 103377 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | - | 1 | ChEMBL | 266 | 3 | 0 | 8 | -1.0 | CC(=O)OCCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL308464 | 103377 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | - | 1 | ChEMBL | 266 | 3 | 0 | 8 | -1.0 | CC(=O)OCCn1c(=O)c2c(ncn2C)n(C)c1=O | 10.1021/jm0104318 | |||
| 135546648 | 109712 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32289 | 109712 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 2 | 2 | ChEMBL | 467 | 8 | 2 | 8 | 2.4 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(F)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 11728808 | 120311 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -15 | 4 | ChEMBL | 388 | 4 | 2 | 8 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL352796 | 120311 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -15 | 4 | ChEMBL | 388 | 4 | 2 | 8 | 3.4 | CCn1cc2c(nc(NC(=O)Nc3ccccc3)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 136042330 | 71154 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 52 | 2 | ChEMBL | 506 | 9 | 3 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)O)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955905 | 71154 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 52 | 2 | ChEMBL | 506 | 9 | 3 | 10 | 2.3 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5cc(C(=O)O)ccc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 21874782 | 176804 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -38 | 4 | ChEMBL | 298 | 3 | 1 | 8 | 2.2 | Nc1nc(-c2ccco2)c2nnn(Cc3cccs3)c2n1 | 10.1021/jm800961g | |||
| CHEMBL460799 | 176804 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -38 | 4 | ChEMBL | 298 | 3 | 1 | 8 | 2.2 | Nc1nc(-c2ccco2)c2nnn(Cc3cccs3)c2n1 | 10.1021/jm800961g | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2006.01.110 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2006.01.110 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.1 | 6.1 | -1479 | 15 | ChEMBL | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10.1016/j.bmcl.2006.01.110 | |||
| 10267860 | 176821 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -12 | 4 | ChEMBL | 317 | 3 | 1 | 8 | 2.0 | N#Cc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| CHEMBL461007 | 176821 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | -12 | 4 | ChEMBL | 317 | 3 | 1 | 8 | 2.0 | N#Cc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| 2748301 | 172285 | None | 8 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 312 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCc2ccccc2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4474844 | 172285 | None | 8 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 312 | 4 | 2 | 4 | 2.7 | CC1=C(C(=O)OCc2ccccc2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 44588436 | 174706 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -1 | 2 | ChEMBL | 341 | 5 | 2 | 5 | 3.0 | CCCn1c(=O)c2[nH]c(-c3ccc(C)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| CHEMBL455985 | 174706 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -1 | 2 | ChEMBL | 341 | 5 | 2 | 5 | 3.0 | CCCn1c(=O)c2[nH]c(-c3ccc(C)cc3)c(O)c2n(CCC)c1=O | 10.1016/j.bmc.2008.09.067 | |||
| 46227950 | 199903 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 4 | 3 | ChEMBL | 396 | 5 | 1 | 6 | 2.0 | C#CCn1c(=O)c2[nH]c(Cc3c(F)cccc3F)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL594728 | 199903 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 4 | 3 | ChEMBL | 396 | 5 | 1 | 6 | 2.0 | C#CCn1c(=O)c2[nH]c(Cc3c(F)cccc3F)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 46227995 | 201442 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 3 | ChEMBL | 430 | 8 | 0 | 9 | 2.9 | CCSCCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL604885 | 201442 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 3 | ChEMBL | 430 | 8 | 0 | 9 | 2.9 | CCSCCn1c(=O)c2c(nc(Cc3cccs3)n2C)n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 44450875 | 96828 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 502 | 6 | 1 | 7 | 3.0 | COc1cc(OCC(=O)N2CCC(c3ccccc3)CC2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL265182 | 96828 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 502 | 6 | 1 | 7 | 3.0 | COc1cc(OCC(=O)N2CCC(c3ccccc3)CC2)ccc1-c1cc2c([nH]1)c(=O)n(C)c(=O)n2C | 10.1016/j.bmc.2008.01.002 | |||
| 44410406 | 75557 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -6760 | 4 | ChEMBL | 472 | 6 | 5 | 10 | 0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)C4CCCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| CHEMBL204526 | 75557 | None | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -6760 | 4 | ChEMBL | 472 | 6 | 5 | 10 | 0.3 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC)nc(C#CC(O)C4CCCCC4)nc32)[C@H](O)[C@@H]1O | 10.1016/j.bmcl.2006.01.110 | |||
| 11198201 | 110675 | None | 7 | Human | Binding | pKi | = | 8.1 | 8.1 | 3 | 3 | ChEMBL | 327 | 5 | 2 | 6 | 2.0 | CCCn1c(=O)c2nc(-c3ccc(N)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL32598 | 110675 | None | 7 | Human | Binding | pKi | = | 8.1 | 8.1 | 3 | 3 | ChEMBL | 327 | 5 | 2 | 6 | 2.0 | CCCn1c(=O)c2nc(-c3ccc(N)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 66894327 | 155972 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(OC(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4061490 | 155972 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 559 | 9 | 1 | 9 | 3.5 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5cccc(OC(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 66894035 | 156201 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 505 | 9 | 1 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4064289 | 156201 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 505 | 9 | 1 | 9 | 2.6 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(OC)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 66894143 | 158440 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 519 | 9 | 1 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(F)c5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4090483 | 158440 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | - | 1 | ChEMBL | 519 | 9 | 1 | 7 | 3.9 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC4CC(=O)N(c5cccc(F)c5)C4)cc3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 9839378 | 140129 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 2 | 4 | ChEMBL | 302 | 5 | 2 | 6 | 1.1 | CCCn1c(=O)c2nc(-c3cn[nH]c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL380176 | 140129 | None | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 2 | 4 | ChEMBL | 302 | 5 | 2 | 6 | 1.1 | CCCn1c(=O)c2nc(-c3cn[nH]c3)[nH]c2n(CCC)c1=O | 10.1021/jm051268+ | |||
| 10852506 | 106979 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | -11 | 6 | ChEMBL | 311 | 4 | 1 | 8 | 2.4 | CC(C)CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL315150 | 106979 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | -11 | 6 | ChEMBL | 311 | 4 | 1 | 8 | 2.4 | CC(C)CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 44219684 | 195766 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 12 | 4 | ChEMBL | 502 | 10 | 2 | 9 | 2.5 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL557694 | 195766 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 12 | 4 | ChEMBL | 502 | 10 | 2 | 9 | 2.5 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(C#N)cc4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 44450955 | 167387 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 43 | 2 | ChEMBL | 530 | 8 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccc(OC)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL429512 | 167387 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 43 | 2 | ChEMBL | 530 | 8 | 1 | 7 | 3.9 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccc(OC)cc5)CC4)cc3)cc21 | 10.1016/j.bmc.2008.01.002 | |||
| 10204847 | 74424 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 23 | 2 | ChEMBL | 460 | 9 | 2 | 6 | 4.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL202665 | 74424 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 23 | 2 | ChEMBL | 460 | 9 | 2 | 6 | 4.0 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 136002248 | 71156 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 269 | 2 | ChEMBL | 564 | 8 | 2 | 9 | 4.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| CHEMBL1955907 | 71156 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 269 | 2 | ChEMBL | 564 | 8 | 2 | 9 | 4.2 | CCCn1c(=O)c2[nH]c(-c3cc(OCc4nc5c(Cl)cc(C(F)(F)F)cc5[nH]4)nn3C)nc2n(CCC)c1=O | 10.1021/jm201292w | |||
| 44574118 | 178804 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 1 | 4 | ChEMBL | 422 | 4 | 2 | 6 | 3.1 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| CHEMBL469119 | 178804 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 1 | 4 | ChEMBL | 422 | 4 | 2 | 6 | 3.1 | Cn1c(=O)c2[nH]c(-c3ccc(COC(=O)Nc4ccc(F)cc4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2009.03.062 | |||
| 11612118 | 140687 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 11 | 2 | ChEMBL | 450 | 7 | 2 | 6 | 3.3 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc21 | 10.1021/jm0506221 | |||
| CHEMBL381538 | 140687 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 11 | 2 | ChEMBL | 450 | 7 | 2 | 6 | 3.3 | CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc(F)cc4)cc3)cc21 | 10.1021/jm0506221 | |||
| 44450826 | 95874 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 25 | 2 | ChEMBL | 524 | 8 | 1 | 6 | 3.9 | O=C(COc1ccc(-c2cc3c([nH]2)c(=O)n(CC2CC2)c(=O)n3CC2CC2)cc1)N1CCc2ccccc2C1 | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259104 | 95874 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 25 | 2 | ChEMBL | 524 | 8 | 1 | 6 | 3.9 | O=C(COc1ccc(-c2cc3c([nH]2)c(=O)n(CC2CC2)c(=O)n3CC2CC2)cc1)N1CCc2ccccc2C1 | 10.1016/j.bmc.2008.01.002 | |||
| 44451253 | 96013 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 33 | 2 | ChEMBL | 491 | 5 | 1 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259733 | 96013 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 33 | 2 | ChEMBL | 491 | 5 | 1 | 7 | 2.1 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCN(c5ccc(F)cc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 44450958 | 96049 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 548 | 6 | 1 | 6 | 4.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| CHEMBL259931 | 96049 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 548 | 6 | 1 | 6 | 4.2 | Cn1c(=O)c2[nH]c(-c3ccc(OCC(=O)N4CCC(c5ccccc5)(c5ccccc5)CC4)cc3)cc2n(C)c1=O | 10.1016/j.bmc.2008.01.002 | |||
| 66893166 | 156962 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 493 | 8 | 1 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4072877 | 156962 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | - | 1 | ChEMBL | 493 | 8 | 1 | 8 | 2.8 | CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(c5ccc(F)cc5)C4)c3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 11656075 | 72306 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 2 | 2 | ChEMBL | 488 | 10 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(CC)C(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL198338 | 72306 | None | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 2 | 2 | ChEMBL | 488 | 10 | 2 | 6 | 4.8 | CCCn1c(=O)c2[nH]c(-c3ccc(OC(CC)C(=O)Nc4ccccc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 8.0 | 8.0 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 8.0 | 8.0 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 8.0 | 8.0 | -30 | 9 | ChEMBL | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10.1021/jm900413e | |||
| 57429610 | 158847 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(OC(F)(F)F)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| CHEMBL4094840 | 158847 | None | 0 | Human | Binding | pKi | = | 8 | 8.0 | - | 1 | ChEMBL | 486 | 6 | 1 | 8 | 3.1 | CCCn1c(=O)c2[nH]c(-c3cnn(CC#Cc4ccc(OC(F)(F)F)cc4)c3)nc2n(CC)c1=O | 10.1016/j.ejmech.2017.04.014 | |||
| 135499926 | 99921 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 2 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5cccc(C(F)(F)F)c5)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL286212 | 99921 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 2 | ChEMBL | 623 | 11 | 2 | 9 | 4.9 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4ccc(OCc5cccc(C(F)(F)F)c5)cc4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 135465778 | 100401 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 22 | 2 | ChEMBL | 480 | 8 | 3 | 9 | 2.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4cccc(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL290105 | 100401 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 22 | 2 | ChEMBL | 480 | 8 | 3 | 9 | 2.8 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Nc4cccc(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 216466 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1016/j.bmc.2010.01.072 | |||
| 5605 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL386974 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL414157 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1016/j.bmc.2010.01.072 | |||
| DB12569 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1016/j.bmc.2010.01.072 | |||
| 216466 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm060539t | |||
| 5605 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm060539t | |||
| CHEMBL386974 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm060539t | |||
| CHEMBL414157 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm060539t | |||
| DB12569 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm060539t | |||
| 216466 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm0605381 | |||
| 5605 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm0605381 | |||
| CHEMBL386974 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm0605381 | |||
| CHEMBL414157 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm0605381 | |||
| DB12569 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | ChEMBL | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 10.1021/jm0605381 | |||
| 136414898 | 157424 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 510 | 9 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5cccc(F)c5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL4078707 | 157424 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | - | 1 | ChEMBL | 510 | 9 | 1 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC4CC(=O)N(c5cccc(F)c5)C4)no3)nc2n(CCC)c1=O | 10.1016/j.ejmech.2016.11.007 | |||
| 10696675 | 28894 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 6 | ChEMBL | 498 | 6 | 2 | 8 | 5.3 | O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| CHEMBL137950 | 28894 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | 1 | 6 | ChEMBL | 498 | 6 | 2 | 8 | 5.3 | O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCc3ccccc3)cc2c2nc(-c3ccco3)nn12 | 10.1021/jm001047y | |||
| 10587109 | 118783 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -31 | 4 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| CHEMBL342059 | 118783 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -31 | 4 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm001047y | |||
| 10587109 | 118783 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -31 | 4 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.ejmech.2015.12.019 | |||
| CHEMBL342059 | 118783 | None | 0 | Human | Binding | pKi | = | 7.1 | 7.1 | -31 | 4 | ChEMBL | 255 | 1 | 1 | 8 | 0.9 | Cn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1 | 10.1016/j.ejmech.2015.12.019 | |||
| 24827594 | 157817 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 274 | 3 | 2 | 5 | 1.2 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| CHEMBL4083334 | 157817 | None | 0 | Human | Binding | pKi | = | 6.1 | 6.1 | - | 1 | ChEMBL | 274 | 3 | 2 | 5 | 1.2 | CCOC(=O)C1=C(C)N/C(=N\C#N)NC1c1ccco1 | 10.1021/acs.jmedchem.7b00138 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2016.11.007 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2016.11.007 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2016.11.007 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2016.11.007 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2016.11.007 | |||
| 162666447 | 182286 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 259 | 2 | 2 | 4 | 2.4 | CC1=C(c2ncc(C)o2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4783984 | 182286 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 259 | 2 | 2 | 4 | 2.4 | CC1=C(c2ncc(C)o2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 9968253 | 190187 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -223 | 4 | ChEMBL | 350 | 4 | 1 | 9 | 1.9 | COC(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL517429 | 190187 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -223 | 4 | ChEMBL | 350 | 4 | 1 | 9 | 1.9 | COC(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm0104318 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2013.09.044 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2013.09.044 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2013.09.044 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2013.09.044 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2010.01.072 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.bmc.2013.09.044 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1039/C8MD00070K | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1039/C8MD00070K | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1039/C8MD00070K | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1039/C8MD00070K | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1039/C8MD00070K | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/acs.jmedchem.5b01586 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/acs.jmedchem.5b01586 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/acs.jmedchem.5b01586 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/acs.jmedchem.5b01586 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/acs.jmedchem.5b01586 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2019.111879 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2019.111879 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2019.111879 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2019.111879 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1016/j.ejmech.2019.111879 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm051268+ | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm051268+ | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm051268+ | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm051268+ | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | ChEMBL | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 10.1021/jm051268+ | |||
| 44390523 | 63814 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(C)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL180236 | 63814 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 500 | 9 | 1 | 9 | 4.3 | CCCn1c(=O)c2nc(-c3ccc(OCc4noc(-c5ccc(C)cc5)n4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 11584408 | 73376 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 7 | 2 | ChEMBL | 518 | 10 | 2 | 6 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc([N+](C)(C)C)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| CHEMBL201447 | 73376 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 7 | 2 | ChEMBL | 518 | 10 | 2 | 6 | 4.2 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4ccc([N+](C)(C)C)cc4)cc3)cc2n(CCC)c1=O | 10.1021/jm0506221 | |||
| 25066016 | 96187 | None | 2 | Human | Binding | pKi | = | 6.0 | 6.0 | -275 | 4 | ChEMBL | 259 | 2 | 0 | 5 | 3.7 | c1csc(-c2nc(C3CC3)nc3ccsc23)n1 | 10.1016/j.bmcl.2008.03.076 | |||
| CHEMBL260719 | 96187 | None | 2 | Human | Binding | pKi | = | 6.0 | 6.0 | -275 | 4 | ChEMBL | 259 | 2 | 0 | 5 | 3.7 | c1csc(-c2nc(C3CC3)nc3ccsc23)n1 | 10.1016/j.bmcl.2008.03.076 | |||
| 145993147 | 166958 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 581 | 13 | 1 | 11 | 1.5 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCOCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| CHEMBL4287298 | 166958 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 581 | 13 | 1 | 11 | 1.5 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCN3CCOCC3)cc2)n(CCC)c1=O | 10.1039/C8MD00070K | |||
| 21874722 | 176818 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -3 | 3 | ChEMBL | 321 | 4 | 2 | 8 | 1.6 | NCc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| CHEMBL460976 | 176818 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -3 | 3 | ChEMBL | 321 | 4 | 2 | 8 | 1.6 | NCc1ccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)cc1 | 10.1021/jm800961g | |||
| 11392671 | 195288 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -416 | 4 | ChEMBL | 308 | 4 | 2 | 5 | 2.6 | Cc1ccccc1CNC(=O)c1cc(-c2ccco2)nc(N)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL551368 | 195288 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -416 | 4 | ChEMBL | 308 | 4 | 2 | 5 | 2.6 | Cc1ccccc1CNC(=O)c1cc(-c2ccco2)nc(N)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 156020727 | 178104 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -6 | 2 | ChEMBL | 323 | 3 | 2 | 6 | 2.6 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cn[nH]c1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4647965 | 178104 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -6 | 2 | ChEMBL | 323 | 3 | 2 | 6 | 2.6 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1cn[nH]c1 | 10.1021/acs.jmedchem.0c00564 | |||
| 45270541 | 195198 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -194 | 4 | ChEMBL | 312 | 4 | 2 | 5 | 2.4 | Nc1nc(C(=O)NCc2cccc(F)c2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| CHEMBL550636 | 195198 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -194 | 4 | ChEMBL | 312 | 4 | 2 | 5 | 2.4 | Nc1nc(C(=O)NCc2cccc(F)c2)cc(-c2ccco2)n1 | 10.1016/j.bmcl.2009.03.142 | |||
| 135483531 | 78539 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 2 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc(Br)cc4)n(C)n3)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL2112067 | 78539 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 2 | ChEMBL | 543 | 9 | 2 | 9 | 2.9 | CCCn1c(=O)c2[nH]c(-c3cc(OCC(=O)Nc4ccc(Br)cc4)n(C)n3)nc2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 45270544 | 195199 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 2 | 2 | ChEMBL | 517 | 10 | 3 | 9 | 2.5 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4nc5ccccc5[nH]4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| CHEMBL550638 | 195199 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 2 | 2 | ChEMBL | 517 | 10 | 3 | 9 | 2.5 | CCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)Nc4nc5ccccc5[nH]4)cc3)nc2n(CCCOC)c1=O | 10.1016/j.bmc.2009.03.029 | |||
| 46227957 | 201368 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 402 | 7 | 1 | 8 | 2.5 | CSCCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| CHEMBL604492 | 201368 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 1 | 3 | ChEMBL | 402 | 7 | 1 | 8 | 2.5 | CSCCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O | 10.1016/j.bmc.2009.07.034 | |||
| 44316058 | 205535 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -104 | 3 | ChEMBL | 468 | 11 | 4 | 6 | 4.8 | Oc1ccc(C[C@@H]2CCCN2CCCCCCN2CCC[C@@H]2Cc2ccc(O)c(O)c2)cc1O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL80974 | 205535 | None | 0 | Rat | Binding | pKi | = | 6.0 | 6.0 | -104 | 3 | ChEMBL | 468 | 11 | 4 | 6 | 4.8 | Oc1ccc(C[C@@H]2CCCN2CCCCCCN2CCC[C@@H]2Cc2ccc(O)c(O)c2)cc1O | 10.1016/0960-894X(95)00413-N | |||
| 21874520 | 176805 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -42 | 4 | ChEMBL | 391 | 5 | 1 | 8 | 2.6 | CC(C)N(C)C(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| CHEMBL460805 | 176805 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -42 | 4 | ChEMBL | 391 | 5 | 1 | 8 | 2.6 | CC(C)N(C)C(=O)c1cccc(Cn2nnc3c(-c4ccco4)nc(N)nc32)c1 | 10.1021/jm800961g | |||
| 44390571 | 64304 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(C(F)(F)F)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| CHEMBL181067 | 64304 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 554 | 9 | 1 | 9 | 5.0 | CCCn1c(=O)c2nc(-c3ccc(OCc4nc(-c5cccc(C(F)(F)F)c5)no4)cc3)[nH]c2n(CCC)c1=O | 10.1016/j.bmcl.2004.11.044 | |||
| 101422 | 91544 | None | 15 | Human | Binding | pKi | = | 5.0 | 5.0 | -2 | 3 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL24049 | 91544 | None | 15 | Human | Binding | pKi | = | 5.0 | 5.0 | -2 | 3 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| 9794423 | 102176 | None | 1 | Human | Binding | pKi | = | 5.0 | 5.0 | - | 1 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)n(C)c(=O)c2c1ncn2C | 10.1021/jm0104318 | |||
| CHEMBL302725 | 102176 | None | 1 | Human | Binding | pKi | = | 5.0 | 5.0 | - | 1 | ChEMBL | 218 | 1 | 0 | 6 | -0.9 | C#CCn1c(=O)n(C)c(=O)c2c1ncn2C | 10.1021/jm0104318 | |||
| 101446 | 92311 | None | 28 | Human | Binding | pKi | = | 5.0 | 5.0 | 1 | 3 | ChEMBL | 220 | 2 | 0 | 6 | -0.4 | C=CCn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| CHEMBL24289 | 92311 | None | 28 | Human | Binding | pKi | = | 5.0 | 5.0 | 1 | 3 | ChEMBL | 220 | 2 | 0 | 6 | -0.4 | C=CCn1cnc2c1c(=O)n(C)c(=O)n2C | 10.1021/jm0104318 | |||
| 44281663 | 168039 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 18 | 2 | ChEMBL | 505 | 10 | 2 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Cc4ccc(OC)c(OC)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL432273 | 168039 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 18 | 2 | ChEMBL | 505 | 10 | 2 | 8 | 3.6 | CCCn1c(=O)c2nc(-c3ccc(NC(=O)Cc4ccc(OC)c(OC)c4)cc3)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 162669067 | 182759 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 276 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC2CCC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL4790210 | 182759 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 276 | 3 | 2 | 4 | 2.0 | CC1=C(C(=O)OC2CCC2)C(c2ccco2)NC(=O)N1 | 10.1021/acs.jmedchem.0c01431 | |||
| 168288152 | 191828 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| CHEMBL5198830 | 191828 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 394 | 6 | 1 | 7 | 2.0 | CCCn1c(=O)c2[nH]c(-c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O | 10.1039/d2md00132b | |||
| 135522363 | 170580 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| CHEMBL445056 | 170580 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 479 | 9 | 2 | 9 | 2.3 | CCCn1c(=O)c2nc(-c3cc(NC(=O)Cc4cccc(OC)c4)nn3C)[nH]c2n(CCC)c1=O | 10.1021/jm0309654 | |||
| 137649307 | 157283 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -6 | 3 | ChEMBL | 348 | 5 | 1 | 4 | 4.4 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3)c2)c1 | 10.1021/acs.jmedchem.7b00860 | |||
| CHEMBL4076880 | 157283 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -6 | 3 | ChEMBL | 348 | 5 | 1 | 4 | 4.4 | COc1cccc(-c2cc(NC(C)=O)nc(-c3cccc(OC)c3)c2)c1 | 10.1021/acs.jmedchem.7b00860 | |||
| 163215620 | 190341 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -398 | 4 | ChEMBL | 318 | 3 | 2 | 6 | 1.8 | Nc1nc(C(=O)NCc2ccccn2)cn2c1nc1ccccc12 | 10.1021/acs.jmedchem.2c00101 | |||
| CHEMBL5176737 | 190341 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -398 | 4 | ChEMBL | 318 | 3 | 2 | 6 | 1.8 | Nc1nc(C(=O)NCc2ccccn2)cn2c1nc1ccccc12 | 10.1021/acs.jmedchem.2c00101 | |||
| CHEMBL5203105 | 190341 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -398 | 4 | ChEMBL | 318 | 3 | 2 | 6 | 1.8 | Nc1nc(C(=O)NCc2ccccn2)cn2c1nc1ccccc12 | 10.1021/acs.jmedchem.2c00101 | |||
| 155542720 | 173161 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 11 | 2 | ChEMBL | 552 | 8 | 3 | 8 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(=O)O)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| CHEMBL4521715 | 173161 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | 11 | 2 | ChEMBL | 552 | 8 | 3 | 8 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(=O)O)cc5)CC4)cc3)[nH]c2c1=O | 10.1021/acs.jmedchem.9b00071 | |||
| 10998551 | 102115 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 220 | 1 | 2 | 4 | 0.5 | O=c1[nH]c2[nH]cnc2c(=O)n1C1CCCC1 | 10.1021/jm0104318 | |||
| CHEMBL302344 | 102115 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 220 | 1 | 2 | 4 | 0.5 | O=c1[nH]c2[nH]cnc2c(=O)n1C1CCCC1 | 10.1021/jm0104318 | |||
| 11004373 | 120250 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -10 | 4 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| CHEMBL352345 | 120250 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -10 | 4 | ChEMBL | 422 | 4 | 2 | 8 | 4.1 | CCn1cc2c(nc(NC(=O)Nc3ccccc3Cl)n3nc(-c4ccco4)nc23)n1 | 10.1021/jm0109614 | |||
| 46837841 | 10623 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 514 | 8 | 0 | 7 | 4.0 | CCCn1c(=O)c2c(cc(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)n2C)n(CCC)c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| CHEMBL1170168 | 10623 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | ChEMBL | 514 | 8 | 0 | 7 | 4.0 | CCCn1c(=O)c2c(cc(-c3ccc(OCC(=O)N4CCc5ccccc5C4)cc3)n2C)n(CCC)c1=O | 10.1016/j.ejmech.2010.03.011 | |||
| 56627882 | 118510 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -194 | 5 | ChEMBL | 367 | 3 | 3 | 12 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1039/C5MD00086F | |||
| CHEMBL3414937 | 118510 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -194 | 5 | ChEMBL | 367 | 3 | 3 | 12 | -0.9 | CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(Cl)nc43)[C@H](O)[C@@H]2O)n1 | 10.1039/C5MD00086F | |||
| 681 | 1464 | None | 72 | Rat | Binding | pKi | = | 6.0 | 6.0 | -15 | 39 | ChEMBL | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | 10.1016/0960-894X(95)00413-N | |||
| 940 | 1464 | None | 72 | Rat | Binding | pKi | = | 6.0 | 6.0 | -15 | 39 | ChEMBL | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | 10.1016/0960-894X(95)00413-N | |||
| 947 | 1464 | None | 72 | Rat | Binding | pKi | = | 6.0 | 6.0 | -15 | 39 | ChEMBL | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | 10.1016/0960-894X(95)00413-N | |||
| CHEMBL59 | 1464 | None | 72 | Rat | Binding | pKi | = | 6.0 | 6.0 | -15 | 39 | ChEMBL | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | 10.1016/0960-894X(95)00413-N | |||
| DB00988 | 1464 | None | 72 | Rat | Binding | pKi | = | 6.0 | 6.0 | -15 | 39 | ChEMBL | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | 10.1016/0960-894X(95)00413-N | |||
| 156018247 | 177778 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -4 | 2 | ChEMBL | 340 | 3 | 1 | 7 | 3.3 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccns1 | 10.1021/acs.jmedchem.0c00564 | |||
| CHEMBL4643113 | 177778 | None | 0 | Human | Binding | pKi | = | 7.0 | 7.0 | -4 | 2 | ChEMBL | 340 | 3 | 1 | 7 | 3.3 | CCOC(=O)C1=C(C)Nc2nc3ccccc3n2C1c1ccns1 | 10.1021/acs.jmedchem.0c00564 | |||
| 11524593 | 141276 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 420 | 9 | 1 | 7 | 3.4 | CCCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(CCCC)c1=O | 10.1021/jm051268+ | |||
| CHEMBL383201 | 141276 | None | 0 | Human | Binding | pKi | = | 6.0 | 6.0 | -1 | 3 | ChEMBL | 420 | 9 | 1 | 7 | 3.4 | CCCCn1c(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2n(CCCC)c1=O | 10.1021/jm051268+ | |||
| 3123319 | 28715 | None | 7 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 252 | 2 | 2 | 5 | 1.7 | COC(=O)C1=C(C)N=C(S)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| CHEMBL1377918 | 28715 | None | 7 | Human | Binding | pKi | = | 6.0 | 6.0 | - | 1 | ChEMBL | 252 | 2 | 2 | 5 | 1.7 | COC(=O)C1=C(C)N=C(S)NC1c1ccco1 | 10.1021/acs.jmedchem.0c01431 | |||
| 19818540 | 75407 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -5 | 2 | ChEMBL | 354 | 6 | 1 | 5 | 3.3 | CC(C)CCn1c(=O)c2nc(-c3ccccc3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0104318 | |||
| CHEMBL20402 | 75407 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -5 | 2 | ChEMBL | 354 | 6 | 1 | 5 | 3.3 | CC(C)CCn1c(=O)c2nc(-c3ccccc3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm0104318 | |||
| 11655061 | 139171 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | -1 | 3 | ChEMBL | 438 | 7 | 1 | 7 | 3.2 | CC(C)Cn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL378743 | 139171 | None | 0 | Human | Binding | pKi | = | 6 | 6.0 | -1 | 3 | ChEMBL | 438 | 7 | 1 | 7 | 3.2 | CC(C)Cn1c(=O)c2nc(-c3cnn(Cc4cccc(F)c4)c3)[nH]c2n(CC(C)C)c1=O | 10.1021/jm051268+ | |||
| CHEMBL5079363 | 214613 | None | 0 | Human | Binding | pKi | = | 5 | 5.0 | -457 | 4 | ChEMBL | None | None | None | Cc1cnc(-c2nc3c(-c4ccc(=O)n(C)c4)cnc(N)n3n2)s1 | 10.1021/acsmedchemlett.1c00599 | |||||
| 3284 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 5728 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 3284 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 5728 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pKd | = | 9.4 | 9.4 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 3284 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 44185871 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 5728 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| CHEMBL483688 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 3284 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 44185871 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 5728 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| CHEMBL483688 | 3214 | None | 35 | Mouse | Binding | pKd | = | 9.5 | 9.5 | 1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKd | = | 9.8 | 9.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKd | = | 9.8 | 9.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKd | = | 9.8 | 9.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKd | = | 9.8 | 9.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| 450 | 2968 | None | 9 | Human | Binding | pKd | None | 9.8 | 9.8 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| 454 | 2968 | None | 9 | Human | Binding | pKd | None | 9.8 | 9.8 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKd | None | 9.8 | 9.8 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKd | None | 9.8 | 9.8 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| 44186666 | 185656 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 144 | 5 | PDSP KiDatabase | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486478 | 185656 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.8 | 9.8 | 144 | 5 | PDSP KiDatabase | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186580 | 184204 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.7 | 9.7 | 30 | 6 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL483261 | 184204 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.7 | 9.7 | 30 | 6 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186668 | 191508 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | 245 | 6 | PDSP KiDatabase | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL519390 | 191508 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.6 | 9.6 | 245 | 6 | PDSP KiDatabase | 562 | 6 | 2 | 7 | 2.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186667 | 185657 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | 478 | 6 | PDSP KiDatabase | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486479 | 185657 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.5 | 9.5 | 478 | 6 | PDSP KiDatabase | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C(F)(F)F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186581 | 3203 | UNDEFINED | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | PDSP KiDatabase | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | None | |||
| 6561 | 3203 | UNDEFINED | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | PDSP KiDatabase | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | None | |||
| CHEMBL482436 | 3203 | UNDEFINED | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | PDSP KiDatabase | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | None | |||
| 450 | 2968 | UNDEFINED | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | PDSP KiDatabase | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | None | |||
| 454 | 2968 | UNDEFINED | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | PDSP KiDatabase | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | None | |||
| 5311041 | 2968 | UNDEFINED | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | PDSP KiDatabase | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | None | |||
| CHEMBL485862 | 2968 | UNDEFINED | 9 | Human | Binding | pKi | = | 9.4 | 9.4 | 257 | 4 | PDSP KiDatabase | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | None | |||
| 44185870 | 184228 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 117 | 5 | PDSP KiDatabase | 514 | 5 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL483487 | 184228 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 117 | 5 | PDSP KiDatabase | 514 | 5 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186626 | 184607 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 245 | 6 | PDSP KiDatabase | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL484900 | 184607 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.4 | 9.4 | 245 | 6 | PDSP KiDatabase | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| 44185872 | 191396 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | 416 | 4 | PDSP KiDatabase | 524 | 5 | 2 | 7 | 1.9 | C#CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL519253 | 191396 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.3 | 9.3 | 416 | 4 | PDSP KiDatabase | 524 | 5 | 2 | 7 | 1.9 | C#CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(Cl)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 3284 | 3214 | UNDEFINED | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | None | |||
| 44185871 | 3214 | UNDEFINED | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | None | |||
| 5728 | 3214 | UNDEFINED | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | None | |||
| CHEMBL483688 | 3214 | UNDEFINED | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | None | |||
| 44186624 | 192434 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 57 | 4 | PDSP KiDatabase | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL520830 | 192434 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 57 | 4 | PDSP KiDatabase | 526 | 7 | 2 | 7 | 2.1 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186582 | 184111 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 158 | 4 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL482638 | 184111 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 158 | 4 | PDSP KiDatabase | 528 | 6 | 2 | 7 | 2.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186625 | 184606 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 208 | 6 | PDSP KiDatabase | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL484899 | 184606 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.2 | 9.2 | 208 | 6 | PDSP KiDatabase | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186669 | 185795 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 354 | 6 | PDSP KiDatabase | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486688 | 185795 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 354 | 6 | PDSP KiDatabase | 576 | 7 | 2 | 7 | 3.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(C(F)(F)F)c5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186622 | 184227 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 208 | 6 | PDSP KiDatabase | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL483469 | 184227 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 208 | 6 | PDSP KiDatabase | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5cccc(Cl)c5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186715 | 191217 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 54 | 4 | PDSP KiDatabase | 522 | 7 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL518972 | 191217 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 54 | 4 | PDSP KiDatabase | 522 | 7 | 2 | 7 | 2.3 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186718 | 184171 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 117 | 6 | PDSP KiDatabase | 538 | 6 | 2 | 9 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL483065 | 184171 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.1 | 9.1 | 117 | 6 | PDSP KiDatabase | 538 | 6 | 2 | 9 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | None | |||
| 44186717 | 184143 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 89 | 6 | PDSP KiDatabase | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL482855 | 184143 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 89 | 6 | PDSP KiDatabase | 538 | 8 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186719 | 185914 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 74 | 6 | PDSP KiDatabase | 552 | 7 | 2 | 9 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486893 | 185914 | UNDEFINED | 0 | Human | Binding | pKi | = | 9.0 | 9.0 | 74 | 6 | PDSP KiDatabase | 552 | 7 | 2 | 9 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc6c(c5)OCO6)CC4)cc3)[nH]c2c1=O | None | |||
| 44186579 | 191782 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 131 | 6 | PDSP KiDatabase | 494 | 6 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL519813 | 191782 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 131 | 6 | PDSP KiDatabase | 494 | 6 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186716 | 184112 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 194 | 6 | PDSP KiDatabase | 524 | 7 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL482648 | 184112 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 194 | 6 | PDSP KiDatabase | 524 | 7 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44583036 | 186953 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 7 | 5 | PDSP KiDatabase | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | None | |||
| CHEMBL490262 | 186953 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 7 | 5 | PDSP KiDatabase | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | None | |||
| CHEMBL521280 | 186953 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 7 | 5 | PDSP KiDatabase | 400 | 8 | 3 | 7 | 0.6 | CCCn1c(=O)c2[nH]c(-c3ccc(OCC(=O)NCCO)cc3)cc2n(C)c1=O | None | |||
| 44186623 | 192087 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 31 | 6 | PDSP KiDatabase | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL520297 | 192087 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.9 | 8.9 | 31 | 6 | PDSP KiDatabase | 512 | 6 | 2 | 7 | 1.7 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(F)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 11605883 | 79950 | UNDEFINED | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | 42 | 6 | PDSP KiDatabase | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL212625 | 79950 | UNDEFINED | 6 | Human | Binding | pKi | = | 8.9 | 8.9 | 42 | 6 | PDSP KiDatabase | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44186670 | 192300 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 24 | 4 | PDSP KiDatabase | 508 | 6 | 2 | 7 | 1.9 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL520617 | 192300 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.8 | 8.8 | 24 | 4 | PDSP KiDatabase | 508 | 6 | 2 | 7 | 1.9 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccc(C)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| None | 217132 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 208 | 4 | PDSP KiDatabase | 485 | 9 | 2 | 7 | 3.9 | CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=C2)C3=CC=C(C=C3)OCC(=O)NC4=CC=C(C=C4)C#N | None | |||
| 44185874 | 185658 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 20 | 5 | PDSP KiDatabase | 524 | 7 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486481 | 185658 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.7 | 8.7 | 20 | 5 | PDSP KiDatabase | 524 | 7 | 2 | 8 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 982689 | 199241 | UNDEFINED | 9 | Human | Binding | pKi | = | 6 | 6.0 | -141 | 3 | PDSP KiDatabase | 414 | 6 | 1 | 5 | 5.3 | COc1ccc(C(=O)c2sc(NC(=O)c3ccccc3)nc2-c2ccccc2)cc1 | None | |||
| CHEMBL590033 | 199241 | UNDEFINED | 9 | Human | Binding | pKi | = | 6 | 6.0 | -141 | 3 | PDSP KiDatabase | 414 | 6 | 1 | 5 | 5.3 | COc1ccc(C(=O)c2sc(NC(=O)c3ccccc3)nc2-c2ccccc2)cc1 | None | |||
| 46229302 | 199281 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | -14 | 4 | PDSP KiDatabase | 382 | 6 | 1 | 6 | 4.6 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccc(OC)cc2)s1 | None | |||
| CHEMBL590301 | 199281 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | -14 | 4 | PDSP KiDatabase | 382 | 6 | 1 | 6 | 4.6 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccc(OC)cc2)s1 | None | |||
| 5033052 | 199482 | UNDEFINED | 14 | Human | Binding | pKi | = | 6 | 6.0 | -173 | 6 | PDSP KiDatabase | 374 | 5 | 1 | 5 | 4.9 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccco1 | None | |||
| CHEMBL591710 | 199482 | UNDEFINED | 14 | Human | Binding | pKi | = | 6 | 6.0 | -173 | 6 | PDSP KiDatabase | 374 | 5 | 1 | 5 | 4.9 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccco1 | None | |||
| 46228971 | 199601 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | -208 | 5 | PDSP KiDatabase | 398 | 5 | 1 | 4 | 5.6 | Cc1ccc(C(=O)c2sc(NC(=O)c3ccccc3)nc2-c2ccccc2)cc1 | None | |||
| CHEMBL592679 | 199601 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | -208 | 5 | PDSP KiDatabase | 398 | 5 | 1 | 4 | 5.6 | Cc1ccc(C(=O)c2sc(NC(=O)c3ccccc3)nc2-c2ccccc2)cc1 | None | |||
| 981611 | 200740 | UNDEFINED | 17 | Human | Binding | pKi | = | 6 | 6.0 | -104 | 4 | PDSP KiDatabase | 384 | 5 | 1 | 4 | 5.3 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccccc1 | None | |||
| CHEMBL600232 | 200740 | UNDEFINED | 17 | Human | Binding | pKi | = | 6 | 6.0 | -104 | 4 | PDSP KiDatabase | 384 | 5 | 1 | 4 | 5.3 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccccc1 | None | |||
| 7315332 | 201067 | UNDEFINED | 5 | Human | Binding | pKi | = | 6 | 6.0 | -2 | 3 | PDSP KiDatabase | 386 | 5 | 1 | 5 | 5.3 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccc(Cl)cc2)s1 | None | |||
| CHEMBL602722 | 201067 | UNDEFINED | 5 | Human | Binding | pKi | = | 6 | 6.0 | -2 | 3 | PDSP KiDatabase | 386 | 5 | 1 | 5 | 5.3 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccc(Cl)cc2)s1 | None | |||
| 46228988 | 201100 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | -83 | 3 | PDSP KiDatabase | 408 | 5 | 1 | 5 | 5.5 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccc(Cl)cc2)s1)c1ccco1 | None | |||
| CHEMBL602950 | 201100 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | -83 | 3 | PDSP KiDatabase | 408 | 5 | 1 | 5 | 5.5 | O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccc(Cl)cc2)s1)c1ccco1 | None | |||
| None | 217570 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 432 | 5 | 1 | 4 | 6.3 | CC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)C(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4 | None | |||
| None | 217571 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 398 | 5 | 1 | 4 | 5.6 | CC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| None | 217572 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 462 | 6 | 1 | 6 | 4.7 | CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| None | 217573 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 434 | 6 | 1 | 6 | 5.2 | CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=C(N=C(S2)NC3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| None | 217574 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 370 | 5 | 1 | 4 | 6.1 | CC1=CC=C(C=C1)C(=O)C2=C(N=C(S2)NC3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| None | 217575 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 386 | 6 | 1 | 5 | 5.8 | COC1=CC=C(C=C1)C(=O)C2=C(N=C(S2)NC3=CC=CC=C3)C4=CC=CC=C4 | None | |||
| None | 217576 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 328 | 4 | 1 | 4 | 4.7 | CNC1=NC(=C(S1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3 | None | |||
| None | 217577 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 324 | 5 | 1 | 5 | 4.1 | CNC1=NC(=C(S1)C(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3 | None | |||
| None | 217578 | UNDEFINED | 0 | Human | Binding | pKi | = | 6 | 6.0 | 1 | 2 | PDSP KiDatabase | 294 | 4 | 1 | 4 | 4.1 | CNC1=NC(=C(S1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3 | None | |||
| 2519 | 778 | UNDEFINED | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 407 | 778 | UNDEFINED | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 463 | 778 | UNDEFINED | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| CHEMBL113 | 778 | UNDEFINED | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| DB00201 | 778 | UNDEFINED | 86 | Human | Binding | pKi | = | 5 | 5.0 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 380 | 1286 | 125I-ABOPX | 54 | Human | Binding | pKi | = | 5 | 5.0 | -17782 | 13 | PDSP KiDatabase | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | None | |||
| 657378 | 1286 | 125I-ABOPX | 54 | Human | Binding | pKi | = | 5 | 5.0 | -17782 | 13 | PDSP KiDatabase | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | None | |||
| CHEMBL68738 | 1286 | 125I-ABOPX | 54 | Human | Binding | pKi | = | 5 | 5.0 | -17782 | 13 | PDSP KiDatabase | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | None | |||
| 11081 | 3215 | UNDEFINED | 5 | Human | Binding | pKi | = | 5 | 5.0 | -30 | 6 | PDSP KiDatabase | 378 | 3 | 1 | 7 | 1.4 | Cn1c(=O)n(C)c(=O)c2c1nc1n2CCCN1CCc1c[nH]c2c1cccc2 | None | |||
| 44437220 | 3215 | UNDEFINED | 5 | Human | Binding | pKi | = | 5 | 5.0 | -30 | 6 | PDSP KiDatabase | 378 | 3 | 1 | 7 | 1.4 | Cn1c(=O)n(C)c(=O)c2c1nc1n2CCCN1CCc1c[nH]c2c1cccc2 | None | |||
| CHEMBL239232 | 3215 | UNDEFINED | 5 | Human | Binding | pKi | = | 5 | 5.0 | -30 | 6 | PDSP KiDatabase | 378 | 3 | 1 | 7 | 1.4 | Cn1c(=O)n(C)c(=O)c2c1nc1n2CCCN1CCc1c[nH]c2c1cccc2 | None | |||
| 44437219 | 90649 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1 | 2 | PDSP KiDatabase | 340 | 3 | 0 | 8 | 0.3 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccn2)n(C)c1=O | None | |||
| CHEMBL239018 | 90649 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1 | 2 | PDSP KiDatabase | 340 | 3 | 0 | 8 | 0.3 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccn2)n(C)c1=O | None | |||
| 3162488 | 91142 | UNDEFINED | 10 | Human | Binding | pKi | = | 5 | 5.0 | -31 | 5 | PDSP KiDatabase | 339 | 3 | 0 | 7 | 0.9 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(C)c1=O | None | |||
| CHEMBL239864 | 91142 | UNDEFINED | 10 | Human | Binding | pKi | = | 5 | 5.0 | -31 | 5 | PDSP KiDatabase | 339 | 3 | 0 | 7 | 0.9 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(C)c1=O | None | |||
| 11003653 | 145836 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -2 | 4 | PDSP KiDatabase | 389 | 4 | 0 | 8 | 1.4 | Cn1c(=O)c2c(nc3n2CCCN3CCOc2ccc(Cl)cc2)n(C)c1=O | None | |||
| CHEMBL391718 | 145836 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -2 | 4 | PDSP KiDatabase | 389 | 4 | 0 | 8 | 1.4 | Cn1c(=O)c2c(nc3n2CCCN3CCOc2ccc(Cl)cc2)n(C)c1=O | None | |||
| 44437233 | 154931 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1 | 3 | PDSP KiDatabase | 368 | 5 | 1 | 8 | 0.4 | Cn1c(=O)c2c(nc3n2CCCN3CCNCc2ccccc2)n(C)c1=O | None | |||
| CHEMBL401028 | 154931 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1 | 3 | PDSP KiDatabase | 368 | 5 | 1 | 8 | 0.4 | Cn1c(=O)c2c(nc3n2CCCN3CCNCc2ccccc2)n(C)c1=O | None | |||
| 3668 | 216120 | 125I-ABOPX | 0 | Human | Binding | pKi | = | 5 | 5.0 | -9120 | 10 | PDSP KiDatabase | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NCC4=CC(=CC=C4)I)O)O | None | |||
| None | 216125 | 125I-ABOPX | 0 | Human | Binding | pKi | = | 5 | 5.0 | -8511 | 5 | PDSP KiDatabase | 385 | 6 | 4 | 9 | 0.5 | CC(CC1=CC=CC=C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O | None | |||
| None | 216290 | 125I-ABOPX | 0 | Human | Binding | pKi | = | 5 | 5.0 | -660 | 6 | PDSP KiDatabase | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3N)NCCC4=CC=C(C=C4)CCC(=O)O)O)O | None | |||
| 235481 | 216292 | 125I-ABOPX | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1258 | 4 | PDSP KiDatabase | 301 | 2 | 4 | 9 | -1.3 | C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)Cl | None | |||
| 235481 | 216292 | UNDEFINED | 0 | Human | Binding | pKi | = | 5 | 5.0 | -1258 | 4 | PDSP KiDatabase | 301 | 2 | 4 | 9 | -1.3 | C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)Cl | None | |||
| None | 216293 | 125I-ABOPX | 0 | Human | Binding | pKi | = | 5 | 5.0 | - | 1 | PDSP KiDatabase | 527 | 6 | 6 | 11 | -0.1 | C1=CC(=C(C=C1CCNC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)I)N | None | |||
| 44583035 | 172739 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 7 | 4 | PDSP KiDatabase | 593 | 5 | 1 | 10 | 3.4 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)nc2n(C)c1=O | None | |||
| CHEMBL450826 | 172739 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.0 | 8.0 | 7 | 4 | PDSP KiDatabase | 593 | 5 | 1 | 10 | 3.4 | Cn1c(=O)c2[nH]c(-c3ccc(OC(C)(C)C(=O)N4CCN(c5nc6cc(Cl)ccc6s5)CC4)cc3)nc2n(C)c1=O | None | |||
| 44185873 | 192485 | UNDEFINED | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 31 | 3 | PDSP KiDatabase | 510 | 6 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL520899 | 192485 | UNDEFINED | 0 | Human | Binding | pKi | = | 7.9 | 7.9 | 31 | 3 | PDSP KiDatabase | 510 | 6 | 2 | 8 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5ccc(OC)cc5)CC4)cc3)[nH]c2c1=O | None | |||
| 1328 | 1368 | 125I-ABOPX | 35 | Human | Binding | pKi | = | 7.9 | 7.9 | -7 | 4 | PDSP KiDatabase | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | None | |||
| 445 | 1368 | 125I-ABOPX | 35 | Human | Binding | pKi | = | 7.9 | 7.9 | -7 | 4 | PDSP KiDatabase | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | None | |||
| CHEMBL11348 | 1368 | 125I-ABOPX | 35 | Human | Binding | pKi | = | 7.9 | 7.9 | -7 | 4 | PDSP KiDatabase | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | None | |||
| 404 | 4096 | 3H-cAMP | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| 432 | 4096 | 3H-cAMP | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| 5697 | 4096 | 3H-cAMP | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| CHEMBL273094 | 4096 | 3H-cAMP | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| 2690 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.8 | 7.8 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 384 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.8 | 7.8 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| CHEMBL16687 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.8 | 7.8 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 377 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 425 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 448222 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| CHEMBL464859 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 5.7 | 5.7 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 44185935 | 185531 | UNDEFINED | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | PDSP KiDatabase | 417 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486281 | 185531 | UNDEFINED | 0 | Human | Binding | pKi | = | 7.7 | 7.7 | 4 | 4 | PDSP KiDatabase | 417 | 5 | 2 | 6 | 1.7 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | None | |||
| 11270783 | 1225 | UNDEFINED | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | PDSP KiDatabase | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | None | |||
| 5615 | 1225 | UNDEFINED | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | PDSP KiDatabase | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | None | |||
| CHEMBL260933 | 1225 | UNDEFINED | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | PDSP KiDatabase | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | None | |||
| DB05936 | 1225 | UNDEFINED | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | PDSP KiDatabase | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | None | |||
| None | 217133 | UNDEFINED | 0 | Human | Binding | pKi | = | 6.6 | 6.6 | 89 | 3 | PDSP KiDatabase | 372 | 4 | 2 | 7 | -2.6 | CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+] | None | |||
| 377 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 425 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 448222 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| CHEMBL464859 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.6 | 6.6 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 44185936 | 185532 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 6 | PDSP KiDatabase | 522 | 8 | 3 | 7 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL486282 | 185532 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.5 | 8.5 | 12 | 6 | PDSP KiDatabase | 522 | 8 | 3 | 7 | 2.4 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)NC4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| 11605883 | 79950 | UNDEFINED | 6 | Human | Binding | pKi | = | 8.4 | 8.4 | 42 | 6 | PDSP KiDatabase | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL212625 | 79950 | UNDEFINED | 6 | Human | Binding | pKi | = | 8.4 | 8.4 | 42 | 6 | PDSP KiDatabase | 508 | 7 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(Cc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| 2690 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 384 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| CHEMBL16687 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 163889 | 1962 | 125I-ABOPX | 17 | Human | Binding | pKi | = | 7.5 | 7.5 | -6 | 8 | PDSP KiDatabase | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | None | |||
| 446 | 1962 | 125I-ABOPX | 17 | Human | Binding | pKi | = | 7.5 | 7.5 | -6 | 8 | PDSP KiDatabase | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | None | |||
| CHEMBL355370 | 1962 | 125I-ABOPX | 17 | Human | Binding | pKi | = | 7.5 | 7.5 | -6 | 8 | PDSP KiDatabase | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | None | |||
| 176407 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 176407 | 4146 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 405 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 405 | 4146 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| CHEMBL113142 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| CHEMBL113142 | 4146 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| DB08770 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| DB08770 | 4146 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 176407 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 405 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| CHEMBL113142 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| DB08770 | 4146 | 125I-ABOPX | 84 | Human | Binding | pKi | = | 7.5 | 7.5 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 377 | 2756 | 125I-ABOPX | 53 | Human | Binding | pKi | = | 6.5 | 6.5 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 425 | 2756 | 125I-ABOPX | 53 | Human | Binding | pKi | = | 6.5 | 6.5 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 448222 | 2756 | 125I-ABOPX | 53 | Human | Binding | pKi | = | 6.5 | 6.5 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| CHEMBL464859 | 2756 | 125I-ABOPX | 53 | Human | Binding | pKi | = | 6.5 | 6.5 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 1241166 | 199282 | UNDEFINED | 21 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | PDSP KiDatabase | 356 | 5 | 1 | 4 | 5.8 | O=C(c1ccccc1)c1sc(Nc2ccccc2)nc1-c1ccccc1 | None | |||
| CHEMBL590302 | 199282 | UNDEFINED | 21 | Human | Binding | pKi | = | 6.5 | 6.5 | 2 | 2 | PDSP KiDatabase | 356 | 5 | 1 | 4 | 5.8 | O=C(c1ccccc1)c1sc(Nc2ccccc2)nc1-c1ccccc1 | None | |||
| 2519 | 778 | [ 3 H]8-(4-(4-(4-chlorophenyl)piperazine-1-sulfonyl)phenyl)-1-propylxanthine ([3H]PSB-603) | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 407 | 778 | [ 3 H]8-(4-(4-(4-chlorophenyl)piperazine-1-sulfonyl)phenyl)-1-propylxanthine ([3H]PSB-603) | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 463 | 778 | [ 3 H]8-(4-(4-(4-chlorophenyl)piperazine-1-sulfonyl)phenyl)-1-propylxanthine ([3H]PSB-603) | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| CHEMBL113 | 778 | [ 3 H]8-(4-(4-(4-chlorophenyl)piperazine-1-sulfonyl)phenyl)-1-propylxanthine ([3H]PSB-603) | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| DB00201 | 778 | [ 3 H]8-(4-(4-(4-chlorophenyl)piperazine-1-sulfonyl)phenyl)-1-propylxanthine ([3H]PSB-603) | 86 | Human | Binding | pKi | = | 4.5 | 4.5 | -11 | 12 | PDSP KiDatabase | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 2690 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 384 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| CHEMBL16687 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 7.5 | 7.5 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 7315331 | 201127 | UNDEFINED | 1 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 4 | PDSP KiDatabase | 352 | 5 | 1 | 5 | 4.6 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1 | None | |||
| CHEMBL603129 | 201127 | UNDEFINED | 1 | Human | Binding | pKi | = | 6.4 | 6.4 | -5 | 4 | PDSP KiDatabase | 352 | 5 | 1 | 5 | 4.6 | CCOC(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1 | None | |||
| None | 217569 | UNDEFINED | 0 | Human | Binding | pKi | = | 5.4 | 5.4 | -3981 | 4 | PDSP KiDatabase | 308 | 3 | 3 | 4 | 3.3 | C1CC(CCC1NC2=NC(=NC3=C2C=CN3)C4=CC=CC=C4)O | None | |||
| 69550 | 204100 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | Drug Central | 238 | 2 | 1 | 7 | -1.5 | Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O | None | |||
| CHEMBL70246 | 204100 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | - | 1 | Drug Central | 238 | 2 | 1 | 7 | -1.5 | Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O | None | |||
| 1892 | 204043 | None | 78 | Human | Binding | pKi | = | 8.3 | 8.3 | 34 | 3 | Drug Central | 224 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCO)n(C)c1=O | None | |||
| CHEMBL699 | 204043 | None | 78 | Human | Binding | pKi | = | 8.3 | 8.3 | 34 | 3 | Drug Central | 224 | 2 | 1 | 7 | -1.6 | Cn1c(=O)c2c(ncn2CCO)n(C)c1=O | None | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | -11 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | -11 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | -11 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | -11 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 8.3 | 8.3 | -11 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 2153 | 3798 | None | 115 | Rat | Binding | pKi | = | 8.3 | 8.3 | -1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | None | 115 | Rat | Binding | pKi | = | 8.3 | 8.3 | -1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | None | 115 | Rat | Binding | pKi | = | 8.3 | 8.3 | -1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | None | 115 | Rat | Binding | pKi | = | 8.3 | 8.3 | -1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | None | 115 | Rat | Binding | pKi | = | 8.3 | 8.3 | -1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2519 | 778 | None | 86 | Mouse | Binding | pKi | = | 8.3 | 8.3 | -1 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 407 | 778 | None | 86 | Mouse | Binding | pKi | = | 8.3 | 8.3 | -1 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 463 | 778 | None | 86 | Mouse | Binding | pKi | = | 8.3 | 8.3 | -1 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| CHEMBL113 | 778 | None | 86 | Mouse | Binding | pKi | = | 8.3 | 8.3 | -1 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| DB00201 | 778 | None | 86 | Mouse | Binding | pKi | = | 8.3 | 8.3 | -1 | 12 | Drug Central | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | None | |||
| 1329 | 1471 | 3H-MRE 3008F20 | 86 | Human | Binding | pKi | = | 7.4 | 7.4 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 386 | 1471 | 3H-MRE 3008F20 | 86 | Human | Binding | pKi | = | 7.4 | 7.4 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| CHEMBL183 | 1471 | 3H-MRE 3008F20 | 86 | Human | Binding | pKi | = | 7.4 | 7.4 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| DB12946 | 1471 | 3H-MRE 3008F20 | 86 | Human | Binding | pKi | = | 7.4 | 7.4 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 163889 | 1962 | 125I-ABOPX | 17 | Human | Binding | pKi | = | 7.4 | 7.4 | -6 | 8 | PDSP KiDatabase | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | None | |||
| 446 | 1962 | 125I-ABOPX | 17 | Human | Binding | pKi | = | 7.4 | 7.4 | -6 | 8 | PDSP KiDatabase | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | None | |||
| CHEMBL355370 | 1962 | 125I-ABOPX | 17 | Human | Binding | pKi | = | 7.4 | 7.4 | -6 | 8 | PDSP KiDatabase | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | None | |||
| 2690 | 902 | 3H-cAMP | 66 | Human | Binding | pKi | = | 7.4 | 7.4 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 384 | 902 | 3H-cAMP | 66 | Human | Binding | pKi | = | 7.4 | 7.4 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| CHEMBL16687 | 902 | 3H-cAMP | 66 | Human | Binding | pKi | = | 7.4 | 7.4 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 2153 | 3798 | None | 115 | Mouse | Binding | pKi | = | 8.3 | 8.3 | 1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | None | 115 | Mouse | Binding | pKi | = | 8.3 | 8.3 | 1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | None | 115 | Mouse | Binding | pKi | = | 8.3 | 8.3 | 1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | None | 115 | Mouse | Binding | pKi | = | 8.3 | 8.3 | 1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | None | 115 | Mouse | Binding | pKi | = | 8.3 | 8.3 | 1 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2099 | 3044 | None | 81 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | Drug Central | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | None | |||
| 4740 | 3044 | None | 81 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | Drug Central | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | None | |||
| 7095 | 3044 | None | 81 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | Drug Central | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | None | |||
| CHEMBL628 | 3044 | None | 81 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | Drug Central | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | None | |||
| DB00806 | 3044 | None | 81 | Human | Binding | pKi | = | 8.3 | 8.3 | 19 | 3 | Drug Central | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | None | |||
| 1676 | 98982 | None | 61 | Human | Binding | pKi | = | 8.3 | 8.3 | -3 | 10 | Drug Central | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| CHEMBL279898 | 98982 | None | 61 | Human | Binding | pKi | = | 8.3 | 8.3 | -3 | 10 | Drug Central | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| 44185934 | 186708 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 14 | 4 | PDSP KiDatabase | 403 | 4 | 2 | 6 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL488542 | 186708 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | 14 | 4 | PDSP KiDatabase | 403 | 4 | 2 | 6 | 1.3 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)[nH]c2c1=O | None | |||
| None | 217131 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.3 | 8.3 | -1 | 11 | PDSP KiDatabase | 116 | 4 | 0 | 2 | 1.4 | CCCCN(C)N=O | None | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 8.3 | 8.3 | -21 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 8.3 | 8.3 | -21 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 8.3 | 8.3 | -21 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 8.3 | 8.3 | -21 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 8.3 | 8.3 | -21 | 14 | Drug Central | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 4882 | 2097 | None | 82 | Human | Binding | pKi | = | 8.2 | 8.2 | -104 | 6 | Drug Central | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | None | |||
| 5311037 | 2097 | None | 82 | Human | Binding | pKi | = | 8.2 | 8.2 | -104 | 6 | Drug Central | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | None | |||
| 5608 | 2097 | None | 82 | Human | Binding | pKi | = | 8.2 | 8.2 | -104 | 6 | Drug Central | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | None | |||
| CHEMBL431770 | 2097 | None | 82 | Human | Binding | pKi | = | 8.2 | 8.2 | -104 | 6 | Drug Central | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | None | |||
| DB11757 | 2097 | None | 82 | Human | Binding | pKi | = | 8.2 | 8.2 | -104 | 6 | Drug Central | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | None | |||
| 169317 | 1200 | 125I-ABOPX | 38 | Human | Binding | pKi | = | 7.3 | 7.3 | -44 | 9 | PDSP KiDatabase | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | None | |||
| 427 | 1200 | 125I-ABOPX | 38 | Human | Binding | pKi | = | 7.3 | 7.3 | -44 | 9 | PDSP KiDatabase | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL157655 | 1200 | 125I-ABOPX | 38 | Human | Binding | pKi | = | 7.3 | 7.3 | -44 | 9 | PDSP KiDatabase | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | None | |||
| 176407 | 4146 | 3H-cAMP | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 405 | 4146 | 3H-cAMP | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| CHEMBL113142 | 4146 | 3H-cAMP | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| DB08770 | 4146 | 3H-cAMP | 84 | Human | Binding | pKi | = | 7.3 | 7.3 | -34 | 6 | PDSP KiDatabase | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | None | |||
| 176408 | 3555 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| 176408 | 3555 | 3H-cAMP | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| 403 | 3555 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| 403 | 3555 | 3H-cAMP | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| 431 | 3555 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| 431 | 3555 | 3H-cAMP | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| CHEMBL17127 | 3555 | 3H-MRE 3008F20 | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| CHEMBL17127 | 3555 | 3H-cAMP | 84 | Human | Binding | pKi | = | 5.3 | 5.3 | -407 | 7 | PDSP KiDatabase | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | None | |||
| 1329 | 1471 | 3H-PSB-298 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 1329 | 1471 | 3H-ZM241385 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 386 | 1471 | 3H-PSB-298 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 386 | 1471 | 3H-ZM241385 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| CHEMBL183 | 1471 | 3H-PSB-298 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| CHEMBL183 | 1471 | 3H-ZM241385 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| DB12946 | 1471 | 3H-PSB-298 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| DB12946 | 1471 | 3H-ZM241385 | 86 | Human | Binding | pKi | = | 7.3 | 7.3 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| None | 216121 | 125I-ABOPX | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | -2 | 5 | PDSP KiDatabase | 382 | 7 | 2 | 6 | 2.5 | CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)C=CC(=O)O | None | |||
| None | 217133 | UNDEFINED | 0 | Human | Binding | pKi | = | 7.3 | 7.3 | 89 | 3 | PDSP KiDatabase | 372 | 4 | 2 | 7 | -2.6 | CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+] | None | |||
| 169317 | 1200 | 125I-ABOPX | 38 | Human | Binding | pKi | = | 7.3 | 7.3 | -44 | 9 | PDSP KiDatabase | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | None | |||
| 427 | 1200 | 125I-ABOPX | 38 | Human | Binding | pKi | = | 7.3 | 7.3 | -44 | 9 | PDSP KiDatabase | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL157655 | 1200 | 125I-ABOPX | 38 | Human | Binding | pKi | = | 7.3 | 7.3 | -44 | 9 | PDSP KiDatabase | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | None | |||
| 377 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 425 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 448222 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| CHEMBL464859 | 2756 | UNDEFINED | 53 | Human | Binding | pKi | = | 6.2 | 6.2 | -1479 | 15 | PDSP KiDatabase | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 10927361 | 90866 | UNDEFINED | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 1 | 4 | PDSP KiDatabase | 395 | 7 | 0 | 7 | 2.6 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(CCC)c1=O | None | |||
| CHEMBL239233 | 90866 | UNDEFINED | 0 | Human | Binding | pKi | = | 6.2 | 6.2 | 1 | 4 | PDSP KiDatabase | 395 | 7 | 0 | 7 | 2.6 | CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2)n(CCC)c1=O | None | |||
| 681 | 1464 | None | 72 | Rat | Binding | pKi | = | 8.2 | 8.2 | -15 | 39 | Drug Central | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
| 940 | 1464 | None | 72 | Rat | Binding | pKi | = | 8.2 | 8.2 | -15 | 39 | Drug Central | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
| 947 | 1464 | None | 72 | Rat | Binding | pKi | = | 8.2 | 8.2 | -15 | 39 | Drug Central | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
| CHEMBL59 | 1464 | None | 72 | Rat | Binding | pKi | = | 8.2 | 8.2 | -15 | 39 | Drug Central | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
| DB00988 | 1464 | None | 72 | Rat | Binding | pKi | = | 8.2 | 8.2 | -15 | 39 | Drug Central | 153 | 2 | 3 | 3 | 0.6 | NCCc1ccc(c(c1)O)O | None | |||
| 1676 | 98982 | 125I-ABOPX | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | PDSP KiDatabase | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| CHEMBL279898 | 98982 | 125I-ABOPX | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | PDSP KiDatabase | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| 1676 | 98982 | 125I-ABOPX | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | PDSP KiDatabase | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| 1676 | 98982 | UNDEFINED | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | PDSP KiDatabase | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| CHEMBL279898 | 98982 | 125I-ABOPX | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | PDSP KiDatabase | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| CHEMBL279898 | 98982 | UNDEFINED | 61 | Human | Binding | pKi | = | 5.2 | 5.2 | -3 | 10 | PDSP KiDatabase | 194 | 2 | 2 | 4 | -0.2 | CCCn1c(=O)[nH]c(=O)c2[nH]cnc21 | None | |||
| 404 | 4096 | 125I-ABOPX | 33 | Human | Binding | pKi | = | 8.1 | 8.1 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| 432 | 4096 | 125I-ABOPX | 33 | Human | Binding | pKi | = | 8.1 | 8.1 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| 5697 | 4096 | 125I-ABOPX | 33 | Human | Binding | pKi | = | 8.1 | 8.1 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| CHEMBL273094 | 4096 | 125I-ABOPX | 33 | Human | Binding | pKi | = | 8.1 | 8.1 | -154 | 11 | PDSP KiDatabase | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | None | |||
| 1153 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 12668023 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 30026874 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 30026875 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 3341 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 6603851 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 933 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 939 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 985 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| CHEMBL1160786 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| CHEMBL1161520 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| CHEMBL588 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| DB00800 | 1626 | None | 58 | Rat | Binding | pKi | = | 8.1 | 8.1 | -5 | 10 | Drug Central | 305 | 1 | 4 | 4 | 2.7 | Oc1ccc(cc1)C1CNCCc2c1cc(O)c(c2Cl)O | None | |||
| 44185932 | 191617 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 11 | 4 | PDSP KiDatabase | 508 | 7 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL519556 | 191617 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 11 | 4 | PDSP KiDatabase | 508 | 7 | 2 | 7 | 1.6 | CCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44185933 | 186707 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 35 | 5 | PDSP KiDatabase | 522 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| CHEMBL488541 | 186707 | UNDEFINED | 0 | Human | Binding | pKi | = | 8.1 | 8.1 | 35 | 5 | PDSP KiDatabase | 522 | 8 | 2 | 7 | 2.0 | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(CCc5ccccc5)CC4)cc3)[nH]c2c1=O | None | |||
| 44437214 | 169252 | UNDEFINED | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -31 | 6 | PDSP KiDatabase | 355 | 3 | 1 | 8 | 0.6 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(C)c1=O | None | |||
| CHEMBL441145 | 169252 | UNDEFINED | 0 | Human | Binding | pKi | = | 5.1 | 5.1 | -31 | 6 | PDSP KiDatabase | 355 | 3 | 1 | 8 | 0.6 | Cn1c(=O)c2c(nc3n2CCCN3CCc2ccc(O)cc2)n(C)c1=O | None | |||
| 1329 | 1471 | [3H]DPCPX | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 386 | 1471 | [3H]DPCPX | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| CHEMBL183 | 1471 | [3H]DPCPX | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| DB12946 | 1471 | [3H]DPCPX | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | PDSP KiDatabase | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | None | |||
| 2153 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2153 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.1 | 5.1 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2690 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 8.0 | 8.0 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 384 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 8.0 | 8.0 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| CHEMBL16687 | 902 | UNDEFINED | 66 | Human | Binding | pKi | = | 8.0 | 8.0 | -30 | 9 | PDSP KiDatabase | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | None | |||
| 216466 | 3843 | UNDEFINED | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | PDSP KiDatabase | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | None | |||
| 5605 | 3843 | UNDEFINED | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | PDSP KiDatabase | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | None | |||
| CHEMBL386974 | 3843 | UNDEFINED | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | PDSP KiDatabase | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | None | |||
| CHEMBL414157 | 3843 | UNDEFINED | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | PDSP KiDatabase | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | None | |||
| DB12569 | 3843 | UNDEFINED | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | PDSP KiDatabase | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | None | |||
| 2153 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | UNDEFINED | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2153 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 2620 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 413 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| CHEMBL190 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| DB00277 | 3798 | 125I-ABOPX | 115 | Human | Binding | pKi | = | 5.0 | 5.0 | -21 | 14 | PDSP KiDatabase | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | None | |||
| 11153 | 2006 | None | 46 | Human | Binding | pKi | = | 7.2 | 7.2 | -35 | 4 | Guide to Pharmacology | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 32727810 | |||
| 86676119 | 2006 | None | 46 | Human | Binding | pKi | = | 7.2 | 7.2 | -35 | 4 | Guide to Pharmacology | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 32727810 | |||
| CHEMBL4594442 | 2006 | None | 46 | Human | Binding | pKi | = | 7.2 | 7.2 | -35 | 4 | Guide to Pharmacology | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 32727810 | |||
| DB16192 | 2006 | None | 46 | Human | Binding | pKi | = | 7.2 | 7.2 | -35 | 4 | Guide to Pharmacology | 315 | 2 | 1 | 5 | 3.3 | Nc1nnc(c(n1)c1ccc(cc1)F)c1cc(C)nc(c1)Cl | 32727810 | |||
| 5595 | 661 | None | 24 | Human | Binding | pKi | = | 3.4 | 3.4 | -16595 | 6 | Guide to Pharmacology | 391 | 5 | 5 | 11 | -0.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=C/C1CCCCC1)nc2N | 16518376 | |||
| 9576912 | 661 | None | 24 | Human | Binding | pKi | = | 3.4 | 3.4 | -16595 | 6 | Guide to Pharmacology | 391 | 5 | 5 | 11 | -0.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=C/C1CCCCC1)nc2N | 16518376 | |||
| CHEMBL1950554 | 661 | None | 24 | Human | Binding | pKi | = | 3.4 | 3.4 | -16595 | 6 | Guide to Pharmacology | 391 | 5 | 5 | 11 | -0.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=C/C1CCCCC1)nc2N | 16518376 | |||
| DB04853 | 661 | None | 24 | Human | Binding | pKi | = | 3.4 | 3.4 | -16595 | 6 | Guide to Pharmacology | 391 | 5 | 5 | 11 | -0.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=C/C1CCCCC1)nc2N | 16518376 | |||
| 423 | 2704 | None | 54 | Human | Binding | pKi | = | 3.8 | 3.8 | -89125 | 8 | Guide to Pharmacology | 349 | 4 | 4 | 9 | 0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCCC1 | 6253037 | |||
| 9841284 | 2704 | None | 54 | Human | Binding | pKi | = | 3.8 | 3.8 | -89125 | 8 | Guide to Pharmacology | 349 | 4 | 4 | 9 | 0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCCC1 | 6253037 | |||
| CHEMBL45891 | 2704 | None | 54 | Human | Binding | pKi | = | 3.8 | 3.8 | -89125 | 8 | Guide to Pharmacology | 349 | 4 | 4 | 9 | 0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCCC1 | 6253037 | |||
| 3086599 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10496952 | |||
| 3086599 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 11093773 | |||
| 3086599 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 16518376 | |||
| 375 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10496952 | |||
| 375 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 11093773 | |||
| 375 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 16518376 | |||
| 424 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10496952 | |||
| 424 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 11093773 | |||
| 424 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 16518376 | |||
| CHEMBL331372 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 10496952 | |||
| CHEMBL331372 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 11093773 | |||
| CHEMBL331372 | 903 | None | 45 | Human | Binding | pKi | = | 4.2 | 4.2 | -3630 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | 16518376 | |||
| 2519 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| 407 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| 463 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| CHEMBL113 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| DB00201 | 778 | None | 86 | Rat | Binding | pKi | = | 4.5 | 4.5 | -47 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| 123807 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10496952 | |||
| 123807 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 16518376 | |||
| 374 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10496952 | |||
| 374 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 16518376 | |||
| 379 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10496952 | |||
| 379 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 16518376 | |||
| CHEMBL284969 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 10496952 | |||
| CHEMBL284969 | 870 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -13803 | 13 | Guide to Pharmacology | 369 | 4 | 4 | 9 | 0.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NC1CCCC1 | 16518376 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 11705449 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 12014951 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 16219300 | |||
| 2153 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 18404493 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 11705449 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 12014951 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 16219300 | |||
| 2620 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 18404493 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 11705449 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 12014951 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 16219300 | |||
| 413 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 18404493 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 11705449 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 12014951 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 16219300 | |||
| CHEMBL190 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 18404493 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 11705449 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 12014951 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 16219300 | |||
| DB00277 | 3798 | None | 115 | Human | Binding | pKi | = | 4.6 | 4.6 | -21 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 18404493 | |||
| 123683 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10496952 | |||
| 123683 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 16518376 | |||
| 422 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10496952 | |||
| 422 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 16518376 | |||
| CHEMBL119709 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10496952 | |||
| CHEMBL119709 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 16518376 | |||
| DB05511 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 10496952 | |||
| DB05511 | 3119 | None | 63 | Human | Binding | pKi | = | 4.6 | 4.6 | -95499 | 13 | Guide to Pharmacology | 510 | 5 | 4 | 9 | 0.4 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1cccc(c1)I | 16518376 | |||
| 380 | 1286 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -17782 | 13 | Guide to Pharmacology | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10496952 | |||
| 380 | 1286 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -17782 | 13 | Guide to Pharmacology | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 16518376 | |||
| 657378 | 1286 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -17782 | 13 | Guide to Pharmacology | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10496952 | |||
| 657378 | 1286 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -17782 | 13 | Guide to Pharmacology | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 16518376 | |||
| CHEMBL68738 | 1286 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -17782 | 13 | Guide to Pharmacology | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 10496952 | |||
| CHEMBL68738 | 1286 | None | 54 | Human | Binding | pKi | = | 4.6 | 4.6 | -17782 | 13 | Guide to Pharmacology | 335 | 4 | 4 | 9 | -0.2 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NC1CCCC1 | 16518376 | |||
| 414 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 10496952 | |||
| 414 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 11093773 | |||
| 414 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 11266650 | |||
| 414 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 16219300 | |||
| 414 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 6253037 | |||
| 93205 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 10496952 | |||
| 93205 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 11093773 | |||
| 93205 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 11266650 | |||
| 93205 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 16219300 | |||
| 93205 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 6253037 | |||
| CHEMBL139000 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 10496952 | |||
| CHEMBL139000 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 11093773 | |||
| CHEMBL139000 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 11266650 | |||
| CHEMBL139000 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 16219300 | |||
| CHEMBL139000 | 3380 | None | 33 | Human | Binding | pKi | = | 4.7 | 4.7 | -19054 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 6253037 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 12014951 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 18404493 | |||
| 2519 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 19569717 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 12014951 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 18404493 | |||
| 407 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 19569717 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 12014951 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 18404493 | |||
| 463 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 19569717 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 12014951 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 18404493 | |||
| CHEMBL113 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 19569717 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 12014951 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 18404493 | |||
| DB00201 | 778 | None | 86 | Human | Binding | pKi | = | 4.7 | 4.7 | -11 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 19569717 | |||
| 414 | 3380 | None | 33 | Mouse | Binding | pKi | = | 4.7 | 4.7 | -16218 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 8135856 | |||
| 93205 | 3380 | None | 33 | Mouse | Binding | pKi | = | 4.7 | 4.7 | -16218 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 8135856 | |||
| CHEMBL139000 | 3380 | None | 33 | Mouse | Binding | pKi | = | 4.7 | 4.7 | -16218 | 12 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C | 8135856 | |||
| 372 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10496952 | |||
| 372 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 11093773 | |||
| 372 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 6253037 | |||
| 8974 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10496952 | |||
| 8974 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 11093773 | |||
| 8974 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 6253037 | |||
| CHEMBL285819 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 10496952 | |||
| CHEMBL285819 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 11093773 | |||
| CHEMBL285819 | 58 | None | 103 | Human | Binding | pKi | = | 4.8 | 4.8 | -2630 | 9 | Guide to Pharmacology | 301 | 2 | 4 | 9 | -1.3 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2N | 6253037 | |||
| 2844 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 2844 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15822182 | |||
| 2844 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 7746802 | |||
| 60961 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 60961 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15822182 | |||
| 60961 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 7746802 | |||
| 90 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 90 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15822182 | |||
| 90 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 7746802 | |||
| CHEMBL477 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| CHEMBL477 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15822182 | |||
| CHEMBL477 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 7746802 | |||
| DB00640 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| DB00640 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15822182 | |||
| DB00640 | 283 | None | 107 | Human | Binding | pKi | = | 4.8 | 4.8 | -467 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 7746802 | |||
| 2519 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.9 | 4.9 | -1 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| 407 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.9 | 4.9 | -1 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| 463 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.9 | 4.9 | -1 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| CHEMBL113 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.9 | 4.9 | -1 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| DB00201 | 778 | None | 86 | Mouse | Binding | pKi | = | 4.9 | 4.9 | -1 | 12 | Guide to Pharmacology | 194 | 0 | 0 | 6 | -1.0 | Cn1cnc2c1c(=O)n(C)c(=O)n2C | 8135856 | |||
| 5353365 | 1209 | None | 32 | Rat | Binding | pKi | = | 5.1 | 5.1 | -263 | 6 | Guide to Pharmacology | 330 | 2 | 0 | 6 | 1.8 | Clc1cccc(c1)/C=C/c1nc2c(n1C)c(=O)n(c(=O)n2C)C | None | |||
| 5609 | 1209 | None | 32 | Rat | Binding | pKi | = | 5.1 | 5.1 | -263 | 6 | Guide to Pharmacology | 330 | 2 | 0 | 6 | 1.8 | Clc1cccc(c1)/C=C/c1nc2c(n1C)c(=O)n(c(=O)n2C)C | None | |||
| CHEMBL26138 | 1209 | None | 32 | Rat | Binding | pKi | = | 5.1 | 5.1 | -263 | 6 | Guide to Pharmacology | 330 | 2 | 0 | 6 | 1.8 | Clc1cccc(c1)/C=C/c1nc2c(n1C)c(=O)n(c(=O)n2C)C | None | |||
| 2153 | 3798 | None | 115 | Mouse | Binding | pKi | = | 5.3 | 5.3 | 1 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 19141710 | |||
| 2620 | 3798 | None | 115 | Mouse | Binding | pKi | = | 5.3 | 5.3 | 1 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 19141710 | |||
| 413 | 3798 | None | 115 | Mouse | Binding | pKi | = | 5.3 | 5.3 | 1 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 19141710 | |||
| CHEMBL190 | 3798 | None | 115 | Mouse | Binding | pKi | = | 5.3 | 5.3 | 1 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 19141710 | |||
| DB00277 | 3798 | None | 115 | Mouse | Binding | pKi | = | 5.3 | 5.3 | 1 | 14 | Guide to Pharmacology | 180 | 0 | 1 | 5 | -1.0 | Cn1c(=O)n(C)c2c(c1=O)[nH]cn2 | 19141710 | |||
| 10046145 | 2681 | None | 18 | Human | Binding | pKi | = | 5.3 | 5.3 | -575 | 6 | Guide to Pharmacology | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 10669571 | |||
| 10046145 | 2681 | None | 18 | Human | Binding | pKi | = | 5.3 | 5.3 | -575 | 6 | Guide to Pharmacology | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 15696333 | |||
| 5610 | 2681 | None | 18 | Human | Binding | pKi | = | 5.3 | 5.3 | -575 | 6 | Guide to Pharmacology | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 10669571 | |||
| 5610 | 2681 | None | 18 | Human | Binding | pKi | = | 5.3 | 5.3 | -575 | 6 | Guide to Pharmacology | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 15696333 | |||
| CHEMBL413079 | 2681 | None | 18 | Human | Binding | pKi | = | 5.3 | 5.3 | -575 | 6 | Guide to Pharmacology | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 10669571 | |||
| CHEMBL413079 | 2681 | None | 18 | Human | Binding | pKi | = | 5.3 | 5.3 | -575 | 6 | Guide to Pharmacology | 394 | 7 | 1 | 8 | 1.1 | OCCCn1c(=O)n(CC#C)c(=O)c2c1nc(n2C)/C=C/c1cccc(c1)OC | 15696333 | |||
| 2844 | 283 | None | 107 | Rat | Binding | pKi | = | 5.3 | 5.3 | -158 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 60961 | 283 | None | 107 | Rat | Binding | pKi | = | 5.3 | 5.3 | -158 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 90 | 283 | None | 107 | Rat | Binding | pKi | = | 5.3 | 5.3 | -158 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| CHEMBL477 | 283 | None | 107 | Rat | Binding | pKi | = | 5.3 | 5.3 | -158 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| DB00640 | 283 | None | 107 | Rat | Binding | pKi | = | 5.3 | 5.3 | -158 | 8 | Guide to Pharmacology | 267 | 2 | 4 | 9 | -2.0 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 2099 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | Guide to Pharmacology | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 12014951 | |||
| 4740 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | Guide to Pharmacology | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 12014951 | |||
| 7095 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | Guide to Pharmacology | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 12014951 | |||
| CHEMBL628 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | Guide to Pharmacology | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 12014951 | |||
| DB00806 | 3044 | None | 81 | Human | Binding | pKi | = | 5.3 | 5.3 | 19 | 3 | Guide to Pharmacology | 278 | 5 | 0 | 7 | 0.2 | CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C | 12014951 | |||
| 3281 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| 9953065 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| CHEMBL4204703 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| CHEMBL592435 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| DB12446 | 1369 | None | 54 | Human | Binding | pKi | = | 5.4 | 5.4 | -4265 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| 135401232 | 3204 | None | 5 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -1698 | 7 | Guide to Pharmacology | 397 | 2 | 1 | 3 | 4.4 | CC[C@H]1N=c2n(C1)c(=O)n(c1c2[nH]c(n1)c1cc(Cl)cc(c1Cl)Cl)C | 12139454 | |||
| 5619 | 3204 | None | 5 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -1698 | 7 | Guide to Pharmacology | 397 | 2 | 1 | 3 | 4.4 | CC[C@H]1N=c2n(C1)c(=O)n(c1c2[nH]c(n1)c1cc(Cl)cc(c1Cl)Cl)C | 12139454 | |||
| CHEMBL1562432 | 3204 | None | 5 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -1698 | 7 | Guide to Pharmacology | 397 | 2 | 1 | 3 | 4.4 | CC[C@H]1N=c2n(C1)c(=O)n(c1c2[nH]c(n1)c1cc(Cl)cc(c1Cl)Cl)C | 12139454 | |||
| 135433658 | 3205 | None | 3 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -208 | 8 | Guide to Pharmacology | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 12139454 | |||
| 5620 | 3205 | None | 3 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -208 | 8 | Guide to Pharmacology | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 12139454 | |||
| 9882625 | 3205 | None | 3 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -208 | 8 | Guide to Pharmacology | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 12139454 | |||
| CHEMBL1625681 | 3205 | None | 3 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -208 | 8 | Guide to Pharmacology | 295 | 2 | 1 | 3 | 2.5 | CC[C@@H]1Cn2c(=N1)c1[nH]c(nc1n(c2=O)C)c1ccccc1 | 12139454 | |||
| 377 | 2756 | None | 53 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -4265 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 425 | 2756 | None | 53 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -4265 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 448222 | 2756 | None | 53 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -4265 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| CHEMBL464859 | 2756 | None | 53 | Mouse | Binding | pKi | = | 5.7 | 5.7 | -4265 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | None | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10779381 | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16219300 | |||
| 459 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16518376 | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10779381 | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16219300 | |||
| 477 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16518376 | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10779381 | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16219300 | |||
| 5310960 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16518376 | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 10779381 | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16219300 | |||
| CHEMBL302765 | 2616 | None | 34 | Human | Binding | pKi | = | 5.8 | 5.8 | -389 | 5 | Guide to Pharmacology | 432 | 6 | 2 | 9 | 3.8 | CCCn1cc2c(n1)nc(n1c2nc(n1)c1ccco1)NC(=O)Nc1ccc(cc1)OC | 16518376 | |||
| 5606 | 1642 | None | 17 | Human | Binding | pKi | = | 6.0 | 6.0 | -1995 | 6 | Guide to Pharmacology | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 16518376 | |||
| 6439091 | 1642 | None | 17 | Human | Binding | pKi | = | 6.0 | 6.0 | -1995 | 6 | Guide to Pharmacology | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 16518376 | |||
| CHEMBL440115 | 1642 | None | 17 | Human | Binding | pKi | = | 6.0 | 6.0 | -1995 | 6 | Guide to Pharmacology | 375 | 5 | 1 | 4 | 3.8 | OCC[C@H]1CCCCN1C(=O)/C=C/c1c(nn2c1cccc2)c1ccccc1 | 16518376 | |||
| 135409562 | 2182 | None | 7 | Human | Binding | pKi | = | 6.2 | 6.2 | -3090 | 4 | Guide to Pharmacology | 373 | 3 | 1 | 3 | 3.3 | CCCn1c2nc([nH]c2c2=NCCn2c1=O)c1ccc(cc1)Br | 12063073 | |||
| 5618 | 2182 | None | 7 | Human | Binding | pKi | = | 6.2 | 6.2 | -3090 | 4 | Guide to Pharmacology | 373 | 3 | 1 | 3 | 3.3 | CCCn1c2nc([nH]c2c2=NCCn2c1=O)c1ccc(cc1)Br | 12063073 | |||
| CHEMBL2181965 | 2182 | None | 7 | Human | Binding | pKi | = | 6.2 | 6.2 | -3090 | 4 | Guide to Pharmacology | 373 | 3 | 1 | 3 | 3.3 | CCCn1c2nc([nH]c2c2=NCCn2c1=O)c1ccc(cc1)Br | 12063073 | |||
| 176408 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 11093773 | |||
| 176408 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 16518376 | |||
| 403 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 11093773 | |||
| 403 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 16518376 | |||
| 431 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 11093773 | |||
| 431 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 16518376 | |||
| CHEMBL17127 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 11093773 | |||
| CHEMBL17127 | 3555 | None | 84 | Human | Binding | pKi | = | 6.3 | 6.3 | -407 | 7 | Guide to Pharmacology | 345 | 4 | 1 | 8 | 2.6 | Nc1nc2n(CCc3ccccc3)ncc2c2n1nc(n2)c1ccco1 | 16518376 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10496952 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11093773 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11266650 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15194002 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15267242 | |||
| 377 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 16219300 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10496952 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11093773 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11266650 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15194002 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15267242 | |||
| 425 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 16219300 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10496952 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11093773 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11266650 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15194002 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15267242 | |||
| 448222 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 16219300 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 10496952 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11093773 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 11266650 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 14662005 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15194002 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 15267242 | |||
| CHEMBL464859 | 2756 | None | 53 | Human | Binding | pKi | = | 6.3 | 6.3 | -1479 | 15 | Guide to Pharmacology | 308 | 3 | 4 | 9 | -1.8 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N | 16219300 | |||
| 3281 | 1369 | None | 54 | Rat | Binding | pKi | = | 6.3 | 6.3 | -537 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| 9953065 | 1369 | None | 54 | Rat | Binding | pKi | = | 6.3 | 6.3 | -537 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| CHEMBL4204703 | 1369 | None | 54 | Rat | Binding | pKi | = | 6.3 | 6.3 | -537 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| CHEMBL592435 | 1369 | None | 54 | Rat | Binding | pKi | = | 6.3 | 6.3 | -537 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| DB12446 | 1369 | None | 54 | Rat | Binding | pKi | = | 6.3 | 6.3 | -537 | 7 | Guide to Pharmacology | 308 | 3 | 3 | 4 | 3.3 | O[C@@H]1CC[C@H](CC1)Nc1nc(nc2c1cc[nH]2)c1ccccc1 | 17558436 | |||
| 5613 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | Guide to Pharmacology | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 16250647 | |||
| 9860294 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | Guide to Pharmacology | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 16250647 | |||
| CHEMBL197669 | 3683 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -45 | 4 | Guide to Pharmacology | 272 | 4 | 1 | 8 | 0.9 | CCCCc1nc(N)c2c(n1)n(C)c(n2)n1nccn1 | 16250647 | |||
| 11717831 | 584 | None | 48 | Mouse | Binding | pKi | = | 6.5 | 6.5 | -60 | 5 | Guide to Pharmacology | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 17632123 | |||
| 3289 | 584 | None | 48 | Mouse | Binding | pKi | = | 6.5 | 6.5 | -60 | 5 | Guide to Pharmacology | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 17632123 | |||
| CHEMBL4202825 | 584 | None | 48 | Mouse | Binding | pKi | = | 6.5 | 6.5 | -60 | 5 | Guide to Pharmacology | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 17632123 | |||
| 5604 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | Guide to Pharmacology | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 17125264 | |||
| 64627 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | Guide to Pharmacology | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 17125264 | |||
| CHEMBL52333 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | Guide to Pharmacology | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 17125264 | |||
| DB05360 | 3366 | None | 35 | Human | Binding | pKi | = | 6.5 | 6.5 | -1995 | 10 | Guide to Pharmacology | 356 | 5 | 1 | 5 | 2.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CC3CC2CC(C1)C3 | 17125264 | |||
| 1329 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| 1329 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12954362 | |||
| 386 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| 386 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12954362 | |||
| CHEMBL183 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| CHEMBL183 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12954362 | |||
| DB12946 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| DB12946 | 1471 | None | 86 | Rat | Binding | pKi | = | 6.7 | 6.7 | -1905 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12954362 | |||
| 11689583 | 3212 | None | 29 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 7 | Guide to Pharmacology | 386 | 7 | 2 | 6 | 2.1 | OCCCn1c2[nH]c(nc2c(=O)n(c1=O)CCCC)C12CC3CC2CC(C1)C3 | 16458010 | |||
| 3285 | 3212 | None | 29 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 7 | Guide to Pharmacology | 386 | 7 | 2 | 6 | 2.1 | OCCCn1c2[nH]c(nc2c(=O)n(c1=O)CCCC)C12CC3CC2CC(C1)C3 | 16458010 | |||
| CHEMBL1316674 | 3212 | None | 29 | Human | Binding | pKi | = | 6.7 | 6.7 | -1513 | 7 | Guide to Pharmacology | 386 | 7 | 2 | 6 | 2.1 | OCCCn1c2[nH]c(nc2c(=O)n(c1=O)CCCC)C12CC3CC2CC(C1)C3 | 16458010 | |||
| 11224 | 581 | None | 35 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| 118016229 | 581 | None | 35 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| CHEMBL4522981 | 581 | None | 35 | Human | Binding | pKi | = | 7.0 | 7.0 | - | 1 | Guide to Pharmacology | 433 | 4 | 1 | 7 | 2.1 | CCn1c(=O)c2c(C)c(sc2n(c1=O)CCC(F)(F)F)C(=O)N1CCC(CC1)O | 30576906 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10624567 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 11266650 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 15194002 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 19141710 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 9459566 | |||
| 2690 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 9933143 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10624567 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 11266650 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 15194002 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 19141710 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 9459566 | |||
| 384 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 9933143 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 10624567 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 11266650 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 15194002 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 19141710 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 9459566 | |||
| CHEMBL16687 | 902 | None | 66 | Human | Binding | pKi | = | 7.1 | 7.1 | -30 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 9933143 | |||
| 216466 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | Guide to Pharmacology | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 17125264 | |||
| 5605 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | Guide to Pharmacology | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 17125264 | |||
| CHEMBL386974 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | Guide to Pharmacology | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 17125264 | |||
| CHEMBL414157 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | Guide to Pharmacology | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 17125264 | |||
| DB12569 | 3843 | None | 32 | Human | Binding | pKi | = | 7.1 | 7.1 | -123 | 6 | Guide to Pharmacology | 416 | 8 | 2 | 6 | 3.2 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C12CCC(CC1)(CC2)CCC(=O)O | 17125264 | |||
| 1329 | 1471 | None | 86 | Mouse | Binding | pKi | = | 7.1 | 7.1 | -870 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 19141710 | |||
| 386 | 1471 | None | 86 | Mouse | Binding | pKi | = | 7.1 | 7.1 | -870 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 19141710 | |||
| CHEMBL183 | 1471 | None | 86 | Mouse | Binding | pKi | = | 7.1 | 7.1 | -870 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 19141710 | |||
| DB12946 | 1471 | None | 86 | Mouse | Binding | pKi | = | 7.1 | 7.1 | -870 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 19141710 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 15194002 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16020631 | |||
| 1329 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16902942 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 15194002 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16020631 | |||
| 386 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16902942 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 15194002 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16020631 | |||
| CHEMBL183 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16902942 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 12014951 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 15194002 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16020631 | |||
| DB12946 | 1471 | None | 86 | Human | Binding | pKi | = | 7.1 | 7.1 | -1288 | 14 | Guide to Pharmacology | 304 | 5 | 1 | 5 | 2.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)C1CCCC1 | 16902942 | |||
| 21874557 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | Guide to Pharmacology | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 19072055 | |||
| 5612 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | Guide to Pharmacology | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 19072055 | |||
| CHEMBL447664 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | Guide to Pharmacology | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 19072055 | |||
| DB06625 | 3994 | None | 51 | Human | Binding | pKi | = | 7.2 | 7.2 | -52 | 4 | Guide to Pharmacology | 321 | 3 | 2 | 8 | 2.0 | Nc1nc(c2ccco2)c2c(n1)n(nn2)Cc1ccc(c(c1)C)N | 19072055 | |||
| 3286 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | Guide to Pharmacology | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 11906291 | |||
| 5311479 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | Guide to Pharmacology | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 11906291 | |||
| CHEMBL8565 | 3207 | None | 31 | Human | Binding | pKi | = | 7.3 | 7.3 | 4 | 9 | Guide to Pharmacology | 350 | 4 | 3 | 6 | 0.7 | CCCn1c(=O)[nH]c2c(c1=O)nc([nH]2)c1ccc(cc1)S(=O)(=O)O | 11906291 | |||
| 11270783 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | Guide to Pharmacology | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 18321039 | |||
| 5615 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | Guide to Pharmacology | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 18321039 | |||
| CHEMBL260933 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | Guide to Pharmacology | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 18321039 | |||
| DB05936 | 1225 | None | 35 | Human | Binding | pKi | = | 7.7 | 7.7 | 67 | 4 | Guide to Pharmacology | 446 | 6 | 1 | 7 | 3.2 | CCCn1c(=O)c2nc([nH]c2n(c1=O)CC)c1cnn(c1)Cc1cccc(c1)C(F)(F)F | 18321039 | |||
| 11716665 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | Guide to Pharmacology | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 17469811 | |||
| 11716665 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | Guide to Pharmacology | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 20137946 | |||
| 5617 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | Guide to Pharmacology | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 17469811 | |||
| 5617 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | Guide to Pharmacology | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 20137946 | |||
| CHEMBL375293 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | Guide to Pharmacology | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 17469811 | |||
| CHEMBL375293 | 2279 | None | 37 | Human | Binding | pKi | = | 7.8 | 7.8 | 58 | 4 | Guide to Pharmacology | 316 | 4 | 1 | 7 | 3.3 | n1ccc(nc1)c1cnc(nc1c1ccco1)Nc1cccnc1 | 20137946 | |||
| 449 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| 449 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 12954362 | |||
| 453 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| 453 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 12954362 | |||
| 6603931 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| 6603931 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 12954362 | |||
| CHEMBL273807 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| CHEMBL273807 | 2641 | None | 52 | Rat | Binding | pKi | = | 7.8 | 7.8 | -9 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 12954362 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10496952 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10624567 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11093773 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11266650 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 15194002 | |||
| 404 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 9459566 | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10496952 | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10624567 | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11093773 | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11266650 | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 15194002 | |||
| 432 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 9459566 | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10496952 | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10624567 | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11093773 | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11266650 | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 15194002 | |||
| 5697 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 9459566 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10496952 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 10624567 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11093773 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 11266650 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 15194002 | |||
| CHEMBL273094 | 4096 | None | 33 | Human | Binding | pKi | = | 7.9 | 7.9 | -154 | 11 | Guide to Pharmacology | 428 | 10 | 3 | 8 | 0.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)NCCN | 9459566 | |||
| 2690 | 902 | None | 66 | Mouse | Binding | pKi | = | 8.0 | 8.0 | -11 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 19141710 | |||
| 384 | 902 | None | 66 | Mouse | Binding | pKi | = | 8.0 | 8.0 | -11 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 19141710 | |||
| CHEMBL16687 | 902 | None | 66 | Mouse | Binding | pKi | = | 8.0 | 8.0 | -11 | 9 | Guide to Pharmacology | 285 | 1 | 1 | 6 | 2.8 | Clc1ccc2c(c1)c1nc(nn1c(n2)N)c1ccco1 | 19141710 | |||
| 24780383 | 515 | None | 0 | Mouse | Binding | pKi | = | 8.1 | 8.1 | -3 | 8 | Guide to Pharmacology | 513 | 6 | 1 | 8 | 3.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)C1CC1)c1ccc(nc1)N(C(=O)c1ccc(nc1)C(F)(F)F)C | 10737749 | |||
| 5616 | 515 | None | 0 | Mouse | Binding | pKi | = | 8.1 | 8.1 | -3 | 8 | Guide to Pharmacology | 513 | 6 | 1 | 8 | 3.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)C1CC1)c1ccc(nc1)N(C(=O)c1ccc(nc1)C(F)(F)F)C | 10737749 | |||
| 11717831 | 584 | None | 48 | Human | Binding | pKi | = | 8.3 | 8.3 | 60 | 5 | Guide to Pharmacology | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 17353435 | |||
| 3289 | 584 | None | 48 | Human | Binding | pKi | = | 8.3 | 8.3 | 60 | 5 | Guide to Pharmacology | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 17353435 | |||
| CHEMBL4202825 | 584 | None | 48 | Human | Binding | pKi | = | 8.3 | 8.3 | 60 | 5 | Guide to Pharmacology | 379 | 7 | 2 | 7 | 2.4 | N#Cc1c(N)nc(c(c1c1ccc(cc1)OCC1CC1)C#N)SCC(=O)N | 17353435 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 4 | Guide to Pharmacology | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 14998332 | |||
| 135484064 | 2614 | None | 4 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 4 | Guide to Pharmacology | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 16219300 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 4 | Guide to Pharmacology | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 14998332 | |||
| 390 | 2614 | None | 4 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 4 | Guide to Pharmacology | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 16219300 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 4 | Guide to Pharmacology | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 14998332 | |||
| CHEMBL260331 | 2614 | None | 4 | Human | Binding | pKi | = | 8.4 | 8.4 | 21 | 4 | Guide to Pharmacology | 509 | 9 | 2 | 11 | 1.9 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc2c(c1)OCO2 | 16219300 | |||
| 11223 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | Guide to Pharmacology | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 26824742 | |||
| 17198004 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | Guide to Pharmacology | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 26824742 | |||
| CHEMBL3787197 | 2075 | None | 24 | Human | Binding | pKi | = | 8.5 | 8.5 | -1 | 4 | Guide to Pharmacology | 337 | 3 | 1 | 6 | 3.9 | CC(OC(=O)C1=C(C)Nc2n(C1c1ccco1)c1ccccc1n2)C | 26824742 | |||
| 449 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 19141710 | |||
| 453 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 19141710 | |||
| 6603931 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 19141710 | |||
| CHEMBL273807 | 2641 | None | 52 | Mouse | Binding | pKi | = | 8.5 | 8.5 | -2 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 19141710 | |||
| 24780383 | 515 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 3 | 8 | Guide to Pharmacology | 513 | 6 | 1 | 8 | 3.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)C1CC1)c1ccc(nc1)N(C(=O)c1ccc(nc1)C(F)(F)F)C | 10737749 | |||
| 5616 | 515 | None | 0 | Human | Binding | pKi | = | 8.6 | 8.6 | 3 | 8 | Guide to Pharmacology | 513 | 6 | 1 | 8 | 3.4 | CCCn1c2nc([nH]c2c(=O)n(c1=O)C1CC1)c1ccc(nc1)N(C(=O)c1ccc(nc1)C(F)(F)F)C | 10737749 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| 449 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| 453 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| 6603931 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 10737749 | |||
| CHEMBL273807 | 2641 | None | 52 | Human | Binding | pKi | = | 8.8 | 8.8 | -1 | 9 | Guide to Pharmacology | 486 | 9 | 2 | 8 | 3.3 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C#N | 11266650 | |||
| 3284 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 44185871 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 5728 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| CHEMBL483688 | 3214 | None | 35 | Human | Binding | pKi | = | 9.3 | 9.3 | -1 | 7 | Guide to Pharmacology | 528 | 6 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)Cl | 19569717 | |||
| 44186581 | 3203 | None | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | Guide to Pharmacology | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 19569717 | |||
| 6561 | 3203 | None | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | Guide to Pharmacology | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 19569717 | |||
| CHEMBL482436 | 3203 | None | 27 | Human | Binding | pKi | = | 9.4 | 9.4 | 851 | 6 | Guide to Pharmacology | 542 | 7 | 2 | 7 | 2.7 | CCCn1c(=O)[nH]c2c(c1=O)[nH]c(n2)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1ccc(cc1)Cl | 19569717 | |||
| 11561692 | 1867 | None | 14 | Human | Binding | pKi | > | 4.3 | 4.3 | -239 | 4 | Guide to Pharmacology | 461 | 6 | 4 | 10 | 1.7 | O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2N[C@@H]1CCC[C@H]1O)CSc1ccccc1F | 19012505 | |||
| 5593 | 1867 | None | 14 | Human | Binding | pKi | > | 4.3 | 4.3 | -239 | 4 | Guide to Pharmacology | 461 | 6 | 4 | 10 | 1.7 | O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2N[C@@H]1CCC[C@H]1O)CSc1ccccc1F | 19012505 | |||
| CHEMBL3545011 | 1867 | None | 14 | Human | Binding | pKi | > | 4.3 | 4.3 | -239 | 4 | Guide to Pharmacology | 461 | 6 | 4 | 10 | 1.7 | O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2N[C@@H]1CCC[C@H]1O)CSc1ccccc1F | 19012505 | |||
| 10981286 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 12109910 | |||
| 10981286 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 17126322 | |||
| 5599 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 12109910 | |||
| 5599 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 17126322 | |||
| 5736 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 12109910 | |||
| 5736 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 17126322 | |||
| CHEMBL260563 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 12109910 | |||
| CHEMBL260563 | 1917 | None | 30 | Human | Binding | pKi | > | 4.5 | 4.5 | -28183 | 4 | Guide to Pharmacology | 361 | 5 | 4 | 9 | 0.0 | CCCCC#Cc1nc(NC)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 17126322 | |||
| 3086599 | 903 | None | 45 | Rat | Binding | pKi | > | 5 | 5.0 | -575 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | None | |||
| 375 | 903 | None | 45 | Rat | Binding | pKi | > | 5 | 5.0 | -575 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | None | |||
| 424 | 903 | None | 45 | Rat | Binding | pKi | > | 5 | 5.0 | -575 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | None | |||
| CHEMBL331372 | 903 | None | 45 | Rat | Binding | pKi | > | 5 | 5.0 | -575 | 8 | Guide to Pharmacology | 499 | 10 | 6 | 11 | -0.2 | CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N | None | |||
| 3035850 | 950 | None | 73 | Human | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| 3035850 | 950 | None | 73 | Mouse | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| 457 | 950 | None | 73 | Human | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| 457 | 950 | None | 73 | Mouse | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| CHEMBL431733 | 950 | None | 73 | Human | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| CHEMBL431733 | 950 | None | 73 | Mouse | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| DB12885 | 950 | None | 73 | Human | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| DB12885 | 950 | None | 73 | Mouse | Binding | pKi | > | 5 | 5.0 | -54954 | 14 | Guide to Pharmacology | 544 | 5 | 4 | 9 | 1.1 | CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)I | None | |||
| 4882 | 2097 | None | 82 | Human | Binding | pKi | > | 5 | 5.0 | -104 | 6 | Guide to Pharmacology | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 21303899 | |||
| 5311037 | 2097 | None | 82 | Human | Binding | pKi | > | 5 | 5.0 | -104 | 6 | Guide to Pharmacology | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 21303899 | |||
| 5608 | 2097 | None | 82 | Human | Binding | pKi | > | 5 | 5.0 | -104 | 6 | Guide to Pharmacology | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 21303899 | |||
| CHEMBL431770 | 2097 | None | 82 | Human | Binding | pKi | > | 5 | 5.0 | -104 | 6 | Guide to Pharmacology | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 21303899 | |||
| DB11757 | 2097 | None | 82 | Human | Binding | pKi | > | 5 | 5.0 | -104 | 6 | Guide to Pharmacology | 384 | 6 | 0 | 8 | 2.1 | COc1cc(/C=C/c2nc3c(n2C)c(=O)n(c(=O)n3CC)CC)ccc1OC | 21303899 | |||
| 393594 | 2634 | None | 42 | Human | Binding | pKi | > | 5 | 5.0 | -354 | 7 | Guide to Pharmacology | 477 | 6 | 1 | 5 | 5.2 | CCOC(=O)C1=C(C)NC(=C(C1C#Cc1ccccc1)C(=O)OCc1ccccc1)c1ccccc1 | None | |||
| 470 | 2634 | None | 42 | Human | Binding | pKi | > | 5 | 5.0 | -354 | 7 | Guide to Pharmacology | 477 | 6 | 1 | 5 | 5.2 | CCOC(=O)C1=C(C)NC(=C(C1C#Cc1ccccc1)C(=O)OCc1ccccc1)c1ccccc1 | None | |||
| CHEMBL1995014 | 2634 | None | 42 | Human | Binding | pKi | > | 5 | 5.0 | -354 | 7 | Guide to Pharmacology | 477 | 6 | 1 | 5 | 5.2 | CCOC(=O)C1=C(C)NC(=C(C1C#Cc1ccccc1)C(=O)OCc1ccccc1)c1ccccc1 | None | |||
| CHEMBL89852 | 2634 | None | 42 | Human | Binding | pKi | > | 5 | 5.0 | -354 | 7 | Guide to Pharmacology | 477 | 6 | 1 | 5 | 5.2 | CCOC(=O)C1=C(C)NC(=C(C1C#Cc1ccccc1)C(=O)OCc1ccccc1)c1ccccc1 | None | |||
| 3661570 | 2639 | None | 53 | Human | Binding | pKi | > | 5 | 5.0 | -102 | 9 | Guide to Pharmacology | 399 | 9 | 0 | 5 | 5.7 | CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(nc1c1ccccc1)CC | None | |||
| 3661570 | 2639 | None | 53 | Mouse | Binding | pKi | > | 5 | 5.0 | -102 | 9 | Guide to Pharmacology | 399 | 9 | 0 | 5 | 5.7 | CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(nc1c1ccccc1)CC | None | |||
| 474 | 2639 | None | 53 | Human | Binding | pKi | > | 5 | 5.0 | -102 | 9 | Guide to Pharmacology | 399 | 9 | 0 | 5 | 5.7 | CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(nc1c1ccccc1)CC | None | |||
| 474 | 2639 | None | 53 | Mouse | Binding | pKi | > | 5 | 5.0 | -102 | 9 | Guide to Pharmacology | 399 | 9 | 0 | 5 | 5.7 | CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(nc1c1ccccc1)CC | None | |||
| CHEMBL111545 | 2639 | None | 53 | Human | Binding | pKi | > | 5 | 5.0 | -102 | 9 | Guide to Pharmacology | 399 | 9 | 0 | 5 | 5.7 | CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(nc1c1ccccc1)CC | None | |||
| CHEMBL111545 | 2639 | None | 53 | Mouse | Binding | pKi | > | 5 | 5.0 | -102 | 9 | Guide to Pharmacology | 399 | 9 | 0 | 5 | 5.7 | CCCOC(=O)c1c(CCC)c(C(=O)SCC)c(nc1c1ccccc1)CC | None | |||
| 11248240 | 2662 | None | 4 | Human | Binding | pKi | > | 5 | 5.0 | -34673 | 10 | Guide to Pharmacology | 462 | 5 | 4 | 8 | 1.8 | CNC(=O)[C@]12C[C@@H]2[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)Cl | 16518376 | |||
| 5601 | 2662 | None | 4 | Human | Binding | pKi | > | 5 | 5.0 | -34673 | 10 | Guide to Pharmacology | 462 | 5 | 4 | 8 | 1.8 | CNC(=O)[C@]12C[C@@H]2[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)Cl | 16518376 | |||
| CHEMBL175543 | 2662 | None | 4 | Human | Binding | pKi | > | 5 | 5.0 | -34673 | 10 | Guide to Pharmacology | 462 | 5 | 4 | 8 | 1.8 | CNC(=O)[C@]12C[C@@H]2[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(Cl)nc2NCc1cccc(c1)Cl | 16518376 | |||
| 219024 | 3298 | None | 65 | Human | Binding | pKi | > | 5 | 5.0 | -229 | 5 | Guide to Pharmacology | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 16518376 | |||
| 2362 | 3298 | None | 65 | Human | Binding | pKi | > | 5 | 5.0 | -229 | 5 | Guide to Pharmacology | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 16518376 | |||
| 5596 | 3298 | None | 65 | Human | Binding | pKi | > | 5 | 5.0 | -229 | 5 | Guide to Pharmacology | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 16518376 | |||
| CHEMBL317052 | 3298 | None | 65 | Human | Binding | pKi | > | 5 | 5.0 | -229 | 5 | Guide to Pharmacology | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 16518376 | |||
| DB06213 | 3298 | None | 65 | Human | Binding | pKi | > | 5 | 5.0 | -229 | 5 | Guide to Pharmacology | 390 | 4 | 5 | 12 | -2.4 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(nc2N)n1ncc(c1)C(=O)NC | 16518376 | |||
| 10668061 | 3551 | None | 70 | Human | Binding | pKi | > | 5 | 5.0 | -64565 | 6 | Guide to Pharmacology | 389 | 6 | 1 | 9 | 3.0 | COc1ccc(cc1)CCCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 16518376 | |||
| 3283 | 3551 | None | 70 | Human | Binding | pKi | > | 5 | 5.0 | -64565 | 6 | Guide to Pharmacology | 389 | 6 | 1 | 9 | 3.0 | COc1ccc(cc1)CCCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 16518376 | |||
| CHEMBL136689 | 3551 | None | 70 | Human | Binding | pKi | > | 5 | 5.0 | -64565 | 6 | Guide to Pharmacology | 389 | 6 | 1 | 9 | 3.0 | COc1ccc(cc1)CCCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 16518376 | |||
| 135546224 | 3763 | None | 0 | Human | Binding | pKi | > | 5 | 5.0 | -3548 | 4 | Guide to Pharmacology | 497 | 7 | 6 | 11 | 1.8 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=N/C(=O)Nc1ccccc1)nc2NC1CCCC1 | 9384502 | |||
| 136218973 | 3763 | None | 0 | Human | Binding | pKi | > | 5 | 5.0 | -3548 | 4 | Guide to Pharmacology | 497 | 7 | 6 | 11 | 1.8 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=N/C(=O)Nc1ccccc1)nc2NC1CCCC1 | 9384502 | |||
| 5590 | 3763 | None | 0 | Human | Binding | pKi | > | 5 | 5.0 | -3548 | 4 | Guide to Pharmacology | 497 | 7 | 6 | 11 | 1.8 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=N/C(=O)Nc1ccccc1)nc2NC1CCCC1 | 9384502 | |||
| CHEMBL2113457 | 3763 | None | 0 | Human | Binding | pKi | > | 5 | 5.0 | -3548 | 4 | Guide to Pharmacology | 497 | 7 | 6 | 11 | 1.8 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N/N=N/C(=O)Nc1ccccc1)nc2NC1CCCC1 | 9384502 | |||
| 10117987 | 3162 | None | 84 | Human | Binding | pKi | > | 6 | 6.0 | -1047 | 6 | Guide to Pharmacology | 503 | 9 | 1 | 12 | 2.2 | COCCOc1ccc(cc1)N1CCN(CC1)CCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 18221214 | |||
| 5614 | 3162 | None | 84 | Human | Binding | pKi | > | 6 | 6.0 | -1047 | 6 | Guide to Pharmacology | 503 | 9 | 1 | 12 | 2.2 | COCCOc1ccc(cc1)N1CCN(CC1)CCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 18221214 | |||
| CHEMBL240624 | 3162 | None | 84 | Human | Binding | pKi | > | 6 | 6.0 | -1047 | 6 | Guide to Pharmacology | 503 | 9 | 1 | 12 | 2.2 | COCCOc1ccc(cc1)N1CCN(CC1)CCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 18221214 | |||
| DB11864 | 3162 | None | 84 | Human | Binding | pKi | > | 6 | 6.0 | -1047 | 6 | Guide to Pharmacology | 503 | 9 | 1 | 12 | 2.2 | COCCOc1ccc(cc1)N1CCN(CC1)CCn1ncc2c1nc(N)n1c2nc(n1)c1ccco1 | 18221214 | |||
| 16109435 | 2377 | None | 10 | Human | Binding | pKi | > | 6.5 | 6.5 | -338 | 4 | Guide to Pharmacology | 353 | 3 | 1 | 2 | 6.3 | C1CCC(CC1)c1nc2c([nH]1)nc(cc2c1ccccc1)c1ccccc1 | 14663020 | |||
| 5607 | 2377 | None | 10 | Human | Binding | pKi | > | 6.5 | 6.5 | -338 | 4 | Guide to Pharmacology | 353 | 3 | 1 | 2 | 6.3 | C1CCC(CC1)c1nc2c([nH]1)nc(cc2c1ccccc1)c1ccccc1 | 14663020 | |||
| CHEMBL219160 | 2377 | None | 10 | Human | Binding | pKi | > | 6.5 | 6.5 | -338 | 4 | Guide to Pharmacology | 353 | 3 | 1 | 2 | 6.3 | C1CCC(CC1)c1nc2c([nH]1)nc(cc2c1ccccc1)c1ccccc1 | 14663020 | |||
| 415 | 3649 | None | 12 | Human | Binding | pKi | None | 4.7 | 4.7 | -1905 | 9 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H](Cc1ccccc1)C | 10496952 | |||
| 415 | 3649 | None | 12 | Human | Binding | pKi | None | 4.7 | 4.7 | -1905 | 9 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H](Cc1ccccc1)C | 16219300 | |||
| 5312112 | 3649 | None | 12 | Human | Binding | pKi | None | 4.7 | 4.7 | -1905 | 9 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H](Cc1ccccc1)C | 10496952 | |||
| 5312112 | 3649 | None | 12 | Human | Binding | pKi | None | 4.7 | 4.7 | -1905 | 9 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H](Cc1ccccc1)C | 16219300 | |||
| CHEMBL420705 | 3649 | None | 12 | Human | Binding | pKi | None | 4.7 | 4.7 | -1905 | 9 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H](Cc1ccccc1)C | 10496952 | |||
| CHEMBL420705 | 3649 | None | 12 | Human | Binding | pKi | None | 4.7 | 4.7 | -1905 | 9 | Guide to Pharmacology | 385 | 6 | 4 | 9 | 0.5 | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@H](Cc1ccccc1)C | 16219300 | |||
| 434 | 223 | None | 0 | Human | Binding | pKi | None | 4.7 | 4.7 | - | 1 | Guide to Pharmacology | 457 | 6 | 6 | 11 | -0.7 | CCNC(=O)C(=O)Nc1nc(Nc2ccccc2)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 10496952 | |||
| 57340157 | 223 | None | 0 | Human | Binding | pKi | None | 4.7 | 4.7 | - | 1 | Guide to Pharmacology | 457 | 6 | 6 | 11 | -0.7 | CCNC(=O)C(=O)Nc1nc(Nc2ccccc2)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO | 10496952 | |||
| 456 | 349 | None | 59 | Human | Binding | pKi | None | 6 | 6.0 | 15 | 3 | Guide to Pharmacology | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 10624567 | |||
| 456 | 349 | None | 59 | Human | Binding | pKi | None | 6 | 6.0 | 15 | 3 | Guide to Pharmacology | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 11266650 | |||
| 5372720 | 349 | None | 59 | Human | Binding | pKi | None | 6 | 6.0 | 15 | 3 | Guide to Pharmacology | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 10624567 | |||
| 5372720 | 349 | None | 59 | Human | Binding | pKi | None | 6 | 6.0 | 15 | 3 | Guide to Pharmacology | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 11266650 | |||
| CHEMBL68500 | 349 | None | 59 | Human | Binding | pKi | None | 6 | 6.0 | 15 | 3 | Guide to Pharmacology | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 10624567 | |||
| CHEMBL68500 | 349 | None | 59 | Human | Binding | pKi | None | 6 | 6.0 | 15 | 3 | Guide to Pharmacology | 214 | 0 | 2 | 4 | 0.2 | O=c1[nH]c2nc3ccccc3nc2c(=O)[nH]1 | 11266650 | |||
| 10221256 | 104 | None | 0 | Human | Binding | pKi | None | 6.3 | 6.3 | - | 1 | Guide to Pharmacology | 277 | 3 | 2 | 5 | 0.7 | CC(Cn1c(=O)[nH]c(=O)c2c1nc([nH]2)N1CCCC1)C | 11705449 | |||
| 447 | 104 | None | 0 | Human | Binding | pKi | None | 6.3 | 6.3 | - | 1 | Guide to Pharmacology | 277 | 3 | 2 | 5 | 0.7 | CC(Cn1c(=O)[nH]c(=O)c2c1nc([nH]2)N1CCCC1)C | 11705449 | |||
| 444 | 1332 | None | 0 | Human | Binding | pKi | None | 6.4 | 6.4 | - | 1 | Guide to Pharmacology | 314 | 5 | 1 | 5 | 2.3 | C=CCn1c2nc([nH]c2c(=O)n(c1=O)CC=C)C1CCCCC1 | 11266650 | |||
| 9926882 | 1332 | None | 0 | Human | Binding | pKi | None | 6.4 | 6.4 | - | 1 | Guide to Pharmacology | 314 | 5 | 1 | 5 | 2.3 | C=CCn1c2nc([nH]c2c(=O)n(c1=O)CC=C)C1CCCCC1 | 11266650 | |||
| 393595 | 2635 | None | 51 | Human | Binding | pKi | None | 6.5 | 6.5 | -97 | 6 | Guide to Pharmacology | 403 | 4 | 1 | 6 | 4.4 | O=C(Nc1nc2ccc(cc2c2n1nc(n2)c1ccco1)Cl)Cc1ccccc1 | 15194002 | |||
| 448 | 2635 | None | 51 | Human | Binding | pKi | None | 6.5 | 6.5 | -97 | 6 | Guide to Pharmacology | 403 | 4 | 1 | 6 | 4.4 | O=C(Nc1nc2ccc(cc2c2n1nc(n2)c1ccco1)Cl)Cc1ccccc1 | 15194002 | |||
| CHEMBL88147 | 2635 | None | 51 | Human | Binding | pKi | None | 6.5 | 6.5 | -97 | 6 | Guide to Pharmacology | 403 | 4 | 1 | 6 | 4.4 | O=C(Nc1nc2ccc(cc2c2n1nc(n2)c1ccco1)Cl)Cc1ccccc1 | 15194002 | |||
| 164437 | 64 | None | 24 | Human | Binding | pKi | None | 6.6 | 6.6 | -114 | 7 | Guide to Pharmacology | 388 | 5 | 4 | 9 | -0.3 | CCCCC#Cc1nc(N)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)C(=O)NCC | 16219300 | |||
| 373 | 64 | None | 24 | Human | Binding | pKi | None | 6.6 | 6.6 | -114 | 7 | Guide to Pharmacology | 388 | 5 | 4 | 9 | -0.3 | CCCCC#Cc1nc(N)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)C(=O)NCC | 16219300 | |||
| CHEMBL410873 | 64 | None | 24 | Human | Binding | pKi | None | 6.6 | 6.6 | -114 | 7 | Guide to Pharmacology | 388 | 5 | 4 | 9 | -0.3 | CCCCC#Cc1nc(N)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)C(=O)NCC | 16219300 | |||
| 443 | 754 | None | 10 | Human | Binding | pKi | None | 7.3 | 7.3 | -3 | 7 | Guide to Pharmacology | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10496952 | |||
| 6439089 | 754 | None | 10 | Human | Binding | pKi | None | 7.3 | 7.3 | -3 | 7 | Guide to Pharmacology | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10496952 | |||
| CHEMBL16997 | 754 | None | 10 | Human | Binding | pKi | None | 7.3 | 7.3 | -3 | 7 | Guide to Pharmacology | 382 | 7 | 2 | 6 | 2.5 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)/C=C/C(=O)O | 10496952 | |||
| 169317 | 1200 | None | 38 | Human | Binding | pKi | None | 7.3 | 7.3 | -44 | 9 | Guide to Pharmacology | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 10496952 | |||
| 169317 | 1200 | None | 38 | Human | Binding | pKi | None | 7.3 | 7.3 | -44 | 9 | Guide to Pharmacology | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 11266650 | |||
| 427 | 1200 | None | 38 | Human | Binding | pKi | None | 7.3 | 7.3 | -44 | 9 | Guide to Pharmacology | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 10496952 | |||
| 427 | 1200 | None | 38 | Human | Binding | pKi | None | 7.3 | 7.3 | -44 | 9 | Guide to Pharmacology | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 11266650 | |||
| CHEMBL157655 | 1200 | None | 38 | Human | Binding | pKi | None | 7.3 | 7.3 | -44 | 9 | Guide to Pharmacology | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 10496952 | |||
| CHEMBL157655 | 1200 | None | 38 | Human | Binding | pKi | None | 7.3 | 7.3 | -44 | 9 | Guide to Pharmacology | 236 | 4 | 1 | 5 | 0.7 | CCCn1c(=O)n(CCC)c2c(c1=O)[nH]cn2 | 11266650 | |||
| 126079 | 4098 | None | 31 | Human | Binding | pKi | None | 7.3 | 7.3 | -2 | 8 | Guide to Pharmacology | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 11266650 | |||
| 451 | 4098 | None | 31 | Human | Binding | pKi | None | 7.3 | 7.3 | -2 | 8 | Guide to Pharmacology | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 11266650 | |||
| CHEMBL27041 | 4098 | None | 31 | Human | Binding | pKi | None | 7.3 | 7.3 | -2 | 8 | Guide to Pharmacology | 386 | 8 | 2 | 7 | 1.8 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)O | 11266650 | |||
| 163889 | 1962 | None | 17 | Human | Binding | pKi | None | 7.4 | 7.4 | -6 | 8 | Guide to Pharmacology | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | 10496952 | |||
| 446 | 1962 | None | 17 | Human | Binding | pKi | None | 7.4 | 7.4 | -6 | 8 | Guide to Pharmacology | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | 10496952 | |||
| CHEMBL355370 | 1962 | None | 17 | Human | Binding | pKi | None | 7.4 | 7.4 | -6 | 8 | Guide to Pharmacology | 575 | 8 | 3 | 8 | 2.7 | CCCn1c(=O)c2[nH]c(nc2n(c1=O)Cc1ccc(c(c1)I)N)c1ccc(cc1)OCC(=O)O | 10496952 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10496952 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11093773 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11266650 | |||
| 176407 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 15194002 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10496952 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11093773 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11266650 | |||
| 405 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 15194002 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10496952 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11093773 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11266650 | |||
| CHEMBL113142 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 15194002 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 10496952 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11093773 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 11266650 | |||
| DB08770 | 4146 | None | 84 | Human | Binding | pKi | None | 7.5 | 7.5 | -34 | 6 | Guide to Pharmacology | 337 | 5 | 3 | 9 | 1.7 | Oc1ccc(cc1)CCNc1nc(N)n2c(n1)nc(n2)c1ccco1 | 15194002 | |||
| 135465785 | 488 | None | 0 | Human | Binding | pKi | None | 7.6 | 7.6 | - | 1 | Guide to Pharmacology | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 439 | 488 | None | 0 | Human | Binding | pKi | None | 7.6 | 7.6 | - | 1 | Guide to Pharmacology | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| CHEMBL32582 | 488 | None | 0 | Human | Binding | pKi | None | 7.6 | 7.6 | - | 1 | Guide to Pharmacology | 496 | 8 | 2 | 12 | 0.0 | CCCn1c2=N/C(=c/3\o[nH]c(c3)OCC(=O)Nc3ccc4c(c3)OCO4)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 135529391 | 481 | None | 0 | Human | Binding | pKi | None | 7.7 | 7.7 | - | 1 | Guide to Pharmacology | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 438 | 481 | None | 0 | Human | Binding | pKi | None | 7.7 | 7.7 | - | 1 | Guide to Pharmacology | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| CHEMBL285900 | 481 | None | 0 | Human | Binding | pKi | None | 7.7 | 7.7 | - | 1 | Guide to Pharmacology | 555 | 10 | 2 | 10 | 1.5 | CCCn1c2=N/C(=c\3/cc([nH]n3C)NC(=O)Cc3ccc(cc3)OCc3ccccc3)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 135443359 | 490 | None | 0 | Human | Binding | pKi | None | 7.7 | 7.7 | - | 1 | Guide to Pharmacology | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 441 | 490 | None | 0 | Human | Binding | pKi | None | 7.7 | 7.7 | - | 1 | Guide to Pharmacology | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| CHEMBL431703 | 490 | None | 0 | Human | Binding | pKi | None | 7.7 | 7.7 | - | 1 | Guide to Pharmacology | 509 | 9 | 3 | 11 | -0.1 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)Nc3ccc(cc3)C(=O)O)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 135529386 | 489 | None | 0 | Human | Binding | pKi | None | 7.8 | 7.8 | - | 1 | Guide to Pharmacology | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 16219300 | |||
| 440 | 489 | None | 0 | Human | Binding | pKi | None | 7.8 | 7.8 | - | 1 | Guide to Pharmacology | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 16219300 | |||
| CHEMBL284615 | 489 | None | 0 | Human | Binding | pKi | None | 7.8 | 7.8 | - | 1 | Guide to Pharmacology | 537 | 10 | 2 | 12 | 0.4 | CCOC(=O)c1ccc(cc1)NC(=O)COc1c/c(=C\2/N=c3c(=N2)c(=O)n(c(=O)n3CCC)CCC)/n([nH]1)C | 16219300 | |||
| 1328 | 1368 | None | 35 | Human | Binding | pKi | None | 7.9 | 7.9 | -7 | 4 | Guide to Pharmacology | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | 10496952 | |||
| 445 | 1368 | None | 35 | Human | Binding | pKi | None | 7.9 | 7.9 | -7 | 4 | Guide to Pharmacology | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | 10496952 | |||
| CHEMBL11348 | 1368 | None | 35 | Human | Binding | pKi | None | 7.9 | 7.9 | -7 | 4 | Guide to Pharmacology | 284 | 3 | 1 | 5 | 1.6 | CCn1c2nc([nH]c2c(=O)n(c1=O)CC)c1ccccc1 | 10496952 | |||
| 135416058 | 491 | None | 0 | Human | Binding | pKi | None | 8 | 8.0 | - | 1 | Guide to Pharmacology | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 16219300 | |||
| 442 | 491 | None | 0 | Human | Binding | pKi | None | 8 | 8.0 | - | 1 | Guide to Pharmacology | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 16219300 | |||
| CHEMBL2113342 | 491 | None | 0 | Human | Binding | pKi | None | 8 | 8.0 | - | 1 | Guide to Pharmacology | 530 | 8 | 1 | 11 | -0.5 | C=CCn1c2=N/C(=c\3/cc([nH]n3C)OCC(=O)N3CCN(CC3)c3ccccc3)/N=c2c(=O)n(c1=O)CC=C | 16219300 | |||
| 135443367 | 487 | None | 0 | Human | Binding | pKi | None | 8.1 | 8.1 | 22 | 2 | Guide to Pharmacology | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 16219300 | |||
| 382 | 487 | None | 0 | Human | Binding | pKi | None | 8.1 | 8.1 | 22 | 2 | Guide to Pharmacology | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 16219300 | |||
| CHEMBL33455 | 487 | None | 0 | Human | Binding | pKi | None | 8.1 | 8.1 | 22 | 2 | Guide to Pharmacology | 534 | 9 | 1 | 10 | 1.8 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)N1CCN(CC1)c1ccccc1 | 16219300 | |||
| 135489238 | 477 | None | 1 | Human | Binding | pKi | None | 8.2 | 8.2 | 30 | 2 | Guide to Pharmacology | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 16219300 | |||
| 381 | 477 | None | 1 | Human | Binding | pKi | None | 8.2 | 8.2 | 30 | 2 | Guide to Pharmacology | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 16219300 | |||
| CHEMBL32802 | 477 | None | 1 | Human | Binding | pKi | None | 8.2 | 8.2 | 30 | 2 | Guide to Pharmacology | 533 | 9 | 2 | 9 | 3.4 | CCCn1c2[nH]c(nc2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)Cl)Cl | 16219300 | |||
| 135476605 | 478 | None | 0 | Human | Binding | pKi | None | 8.4 | 8.4 | - | 1 | Guide to Pharmacology | 525 | 10 | 2 | 13 | 0.2 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OC(=O)CNc3ccc(c(c3)OC)OC)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 437 | 478 | None | 0 | Human | Binding | pKi | None | 8.4 | 8.4 | - | 1 | Guide to Pharmacology | 525 | 10 | 2 | 13 | 0.2 | CCCn1c2=N/C(=c\3/cc([nH]n3C)OC(=O)CNc3ccc(c(c3)OC)OC)/N=c2c(=O)n(c1=O)CCC | 16219300 | |||
| 135522368 | 492 | None | 1 | Human | Binding | pKi | None | 8.4 | 8.4 | 117 | 2 | Guide to Pharmacology | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 16219300 | |||
| 383 | 492 | None | 1 | Human | Binding | pKi | None | 8.4 | 8.4 | 117 | 2 | Guide to Pharmacology | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 16219300 | |||
| CHEMBL33491 | 492 | None | 1 | Human | Binding | pKi | None | 8.4 | 8.4 | 117 | 2 | Guide to Pharmacology | 493 | 9 | 2 | 9 | 2.7 | CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1cc(nn1C)OCC(=O)Nc1ccc(c(c1)C)C | 16219300 | |||
| 450 | 2968 | None | 9 | Human | Binding | pKi | None | 9.3 | 9.3 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| 454 | 2968 | None | 9 | Human | Binding | pKi | None | 9.3 | 9.3 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| 5311041 | 2968 | None | 9 | Human | Binding | pKi | None | 9.3 | 9.3 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||
| CHEMBL485862 | 2968 | None | 9 | Human | Binding | pKi | None | 9.3 | 9.3 | 257 | 4 | Guide to Pharmacology | 525 | 10 | 3 | 6 | 3.6 | CC(=O)NCCNc1nc(nc2c1cc([nH]2)C(=O)N1CCN(CC1)CCCc1ccccc1)c1ccccc1 | 15194002 | |||