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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50306966   
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))		BDBM50306966
PNG
((S)-4-(4-(4-carbamoylpiperazin-1-yl)-6-phenylpicol...)
Show SMILES CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(cc(n1)-c1ccccc1)N1CCN(CC1)C(N)=O |r|
Show InChI InChI=1S/C32H43N7O7/c1-2-3-7-20-46-32(45)39-18-14-37(15-19-39)30(43)25(10-11-28(40)41)35-29(42)27-22-24(36-12-16-38(17-13-36)31(33)44)21-26(34-27)23-8-5-4-6-9-23/h4-6,8-9,21-22,25H,2-3,7,10-20H2,1H3,(H2,33,44)(H,35,42)(H,40,41)/t25-/m0/s1
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Similars
Article
PubMed
 6.30n/an/an/an/an/an/an/an/a



Pfizer Global Research& Development

Curated by ChEMBL


Assay Description
Inhibition of human P2Y12 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 1388-94 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.110
BindingDB Entry DOI: 10.7270/Q2ZP467B
More data for this
Ligand-Target Pair