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BDBM50120452 1-(2-Chloro-2-phenyl-ethyl)-4-cyclohexylamino-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester::CHEMBL144754

SMILES: CCOC(=O)c1cnc2n(CC(Cl)c3ccccc3)ncc2c1NC1CCCCC1

InChI Key: InChIKey=WOCXDLCUXSXXSY-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50120452   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Adenosine A1 receptor


(BOVINE)		BDBM50120452
PNG
(1-(2-Chloro-2-phenyl-ethyl)-4-cyclohexylamino-1H-p...)
Show SMILES CCOC(=O)c1cnc2n(CC(Cl)c3ccccc3)ncc2c1NC1CCCCC1
Show InChI InChI=1S/C23H27ClN4O2/c1-2-30-23(29)19-13-25-22-18(21(19)27-17-11-7-4-8-12-17)14-26-28(22)15-20(24)16-9-5-3-6-10-16/h3,5-6,9-10,13-14,17,20H,2,4,7-8,11-12,15H2,1H3,(H,25,27)
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Similars
PubMed
 1.49E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Genova

Curated by ChEMBL


Assay Description
Binding affinity to Adenosine A1 receptor in bovine cortical membranes by [3H]N6-cyclohexyl adenosine displacement.

J Med Chem 45: 4875-87 (2002)


BindingDB Entry DOI: 10.7270/Q2N87BHS
More data for this
Ligand-Target Pair