GPCRdb

SCH 58261

Agent/drug
Bioactivity

SCH 58261

SMILES	Nc1nc2c(cnn2CCc2ccccc2)c2nc(-c3ccco3)nn12
InChIKey	UTLPKQYUXOEJIL-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	8
Hydrogen bond donors	1
Rotatable bonds	4
Molecular weight (Da)	345.1

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology GPCRdb
Ligand site mutations	A₁ A_2A A_2B

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

A₁	AA1R	Human	Adenosine	A	pKi	6.10	6.20	6.30	Guide to Pharmacology
A₁	AA1R	Rat	Adenosine	A	pKi	6.41	6.61	6.92	ChEMBL
A₁	AA1R	Human	Adenosine	A	pKi	6.23	6.47	7.21	ChEMBL
A₁	AA1R	Human	Adenosine	A	pKi	6.54	6.54	6.54	PDSP Ki database
A₁	AA1R	Bovine	Adenosine	A	pKi	6.45	6.45	6.45	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKi	8.30	8.75	9.20	Guide to Pharmacology
A_2A	AA2AR	Human	Adenosine	A	pKd	8.60	8.80	9.00	Guide to Pharmacology
A_2A	AA2AR	Rat	Adenosine	A	pKi	5.72	7.71	8.64	ChEMBL
A_2A	AA2AR	Rat	Adenosine	A	pKd	9.15	9.15	9.15	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKi	8.37	8.84	9.22	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKd	7.78	8.31	8.71	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKi	9.22	9.22	9.22	PDSP Ki database
A_2B	AA2BR	Human	Adenosine	A	pKi	6.00	6.25	6.50	Guide to Pharmacology
A_2B	AA2BR	Human	Adenosine	A	pKi	5.96	6.17	6.59	ChEMBL
A_2B	AA2BR	Human	Adenosine	A	pKi	5.30	5.30	5.30	PDSP Ki database
A₃	AA3R	Human	Adenosine	A	pKi	5.92	5.92	5.92	Guide to Pharmacology
A₃	AA3R	Human	Adenosine	A	pKi	5.92	5.92	5.92	ChEMBL
A₃	AA3R	Human	Adenosine	A	pKi	5.00	5.00	5.00	PDSP Ki database

Showing 1 to 18 of 18 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

A_2A	AA2AR	Human	Adenosine	A	pIC50	7.40	7.66	7.92	ChEMBL

Showing 1 to 1 of 1 entry

SCH 58261

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 Guide To Pharmacology GPCRdb
Ligand site mutations	A₁ A_2A A_2B

Compound is not listed as a drug.