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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50534157'   
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 A3


(Homo sapiens (Human))		BDBM50534157
PNG
(CHEMBL4444501)
Show SMILES Cn1c2nc3CN(CCc4ccc5OCOc5c4)CCn3c2c(=O)n(C)c1=O
Show InChI InChI=1S/C19H21N5O4/c1-21-17-16(18(25)22(2)19(21)26)24-8-7-23(10-15(24)20-17)6-5-12-3-4-13-14(9-12)28-11-27-13/h3-4,9H,5-8,10-11H2,1-2H3
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PC cid
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Article
PubMed
>3.00E+3n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]PSB-11 from human A3 receptor expressed in CHO cell membrane by liquid scintillation counting method relative to control

Bioorg Med Chem 24: 5462-5480 (2016)


Article DOI: 10.1016/j.bmc.2016.09.003
BindingDB Entry DOI: 10.7270/Q2RB7836
More data for this
Ligand-Target Pair