GPCRdb

SB 224289

Agent/drug
Bioactivity

SB 224289

SMILES	Cc1nc(-c2ccc(-c3ccc(C(=O)N4CCc5cc6c(cc54)C4(CCN(C)CC4)CO6)cc3)c(C)c2)no1
InChIKey	ATQMRMGXINTJHV-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	0
Rotatable bonds	3
Molecular weight (Da)	520.2

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1D	ADA1D	Human	Adrenoceptors	A	pKi	5.68	5.68	5.68	ChEMBL
α_2A	ADA2A	Human	Adrenoceptors	A	pKi	5.61	5.61	5.61	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	5.66	5.66	5.66	ChEMBL
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	6.00	6.00	6.00	PDSP Ki database
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	8.20	8.40	8.60	Guide to Pharmacology
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	8.00	8.19	8.56	ChEMBL
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	8.16	8.16	8.16	PDSP Ki database
5-HT_1B	5HT1B	Rat	5-Hydroxytryptamine	A	pKi	7.52	7.52	7.52	PDSP Ki database
5-HT_1B	5HT1B	Guinea pig	5-Hydroxytryptamine	A	pKi	8.44	8.44	8.44	PDSP Ki database
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	6.30	6.30	6.30	Guide to Pharmacology
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	6.30	6.44	6.58	ChEMBL
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	6.27	6.27	6.27	PDSP Ki database
5-HT_1E	5HT1E	Human	5-Hydroxytryptamine	A	pKi	5.00	5.00	5.00	PDSP Ki database
5-HT_1F	5HT1F	Human	5-Hydroxytryptamine	A	pKi	5.00	5.00	5.00	PDSP Ki database
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.30	5.30	5.30	Guide to Pharmacology
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.75	5.78	5.80	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.30	5.61	5.92	PDSP Ki database
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	5.90	5.90	5.90	Guide to Pharmacology
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	5.50	5.69	5.87	PDSP Ki database
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	5.95	5.95	5.95	Guide to Pharmacology

Showing 1 to 20 of 30 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_1B	5HT1B	Rat	5-Hydroxytryptamine	A	pIC50	8.70	8.70	8.70	ChEMBL
apelin	APJ	Human	Apelin	A	pIC50	5.44	5.44	5.44	ChEMBL
FPR1	FPR1	Human	Formylpeptide	A	pIC50	5.37	5.37	5.37	ChEMBL
FPR3	FPR3	Human	Formylpeptide	A	pIC50	5.42	5.42	5.42	ChEMBL
GPR183	GP183	Human	A orphans	A	pIC50	5.19	5.19	5.19	ChEMBL
GPR35	GPR35	Human	A orphans	A	pIC50	5.34	5.34	5.34	ChEMBL
GPR65	PSYR	Human	A orphans	A	pIC50	5.39	5.39	5.39	ChEMBL
M₁	ACM1	Rat	Acetylcholine (muscarinic)	A	Potency	4.80	4.82	4.85	ChEMBL
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pIC50	5.47	5.47	5.47	ChEMBL
TSH	TSHR	Human	Glycoprotein hormone	A	Potency	5.10	5.10	5.10	ChEMBL

Showing 1 to 10 of 10 entries

SB 224289

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Distribution across phases (no. indications)

Phase I 0

Phase II 0

Phase III 0

Phase IV

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids GPCRdb

Compound is not listed as a drug.