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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a' and Ligand = 'BDBM50097444'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Adenosine receptor A2a


(Rattus norvegicus (rat))		BDBM50097444
PNG
(3-Chloro-N-(4-pyridin-2-yl-thiazol-2-yl)-benzamide...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(cs1)-c1ccccn1
Show InChI InChI=1S/C15H10ClN3OS/c16-11-5-3-4-10(8-11)14(20)19-15-18-13(9-21-15)12-6-1-2-7-17-12/h1-9H,(H,18,19,20)
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MMDB

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PC sid
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Similars
PubMed
 1.30E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGS-21,680 or [3H]ZM-241385 binding in adenosine A2A receptor of rat striatal membrane was determined

J Med Chem 44: 749-62 (2001)


BindingDB Entry DOI: 10.7270/Q2H132Q0
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Ligand-Target Pair