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BDBM50088464 1-(2-tert-Butyl-quinazolin-4-yl)-3-phenyl-urea::CHEMBL72007

SMILES: CC(C)(C)c1nc(NC(=O)Nc2ccccc2)c2ccccc2n1

InChI Key: InChIKey=ABIZQMXTMRRNQH-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50088464   
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 receptor A3


(Homo sapiens (Human))		BDBM50088464
PNG
(1-(2-tert-Butyl-quinazolin-4-yl)-3-phenyl-urea | C...)
Show SMILES CC(C)(C)c1nc(NC(=O)Nc2ccccc2)c2ccccc2n1
Show InChI InChI=1S/C19H20N4O/c1-19(2,3)17-21-15-12-8-7-11-14(15)16(22-17)23-18(24)20-13-9-5-4-6-10-13/h4-12H,1-3H3,(H2,20,21,22,23,24)
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PubMed
 7.87E+7n/an/an/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Binding affinity of the compound was determined by its ability to displace [125I]-AB-MECA from human adenosine A3 receptor expressed in HEK 293 cells

J Med Chem 43: 2227-38 (2000)


BindingDB Entry DOI: 10.7270/Q2T72GNJ
More data for this
Ligand-Target Pair