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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50397155   
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
P2Y purinoceptor 12


(Homo sapiens (Human))		BDBM50397155
PNG
(CHEMBL2172130)
Show SMILES CCOC(=O)N1CCN(CC1)C(=O)[C@H](CCN)NC(=O)c1cc(OCC(=O)N2CCC[C@H]2C(=O)NC2CCC2)n(n1)-c1ccccc1 |r|
Show InChI InChI=1S/C32H44N8O7/c1-2-46-32(45)38-18-16-37(17-19-38)31(44)24(13-14-33)35-29(42)25-20-28(40(36-25)23-10-4-3-5-11-23)47-21-27(41)39-15-7-12-26(39)30(43)34-22-8-6-9-22/h3-5,10-11,20,22,24,26H,2,6-9,12-19,21,33H2,1H3,(H,34,43)(H,35,42)/t24-,26-/m0/s1
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 180n/an/an/an/an/an/an/an/a



Sanofi-Aventis Deutschland GmbH

Curated by ChEMBL


Assay Description
Displacement of [33P]2-MeS-ADP from human recombinant P2Y12 receptor expressed in CHO cell membranes by scintillation counting method

J Med Chem 55: 8615-29 (2012)


Article DOI: 10.1021/jm300771j
BindingDB Entry DOI: 10.7270/Q2D50P3P
More data for this
Ligand-Target Pair