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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'P2Y purinoceptor 14' and Ligand = 'BDBM50343114'   
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 14


(Mus musculus)		BDBM50343114
PNG
(4-(3-chlorophenyl)-N-(3-ethylphenyl)-2-(pyridin-3-...)
Show SMILES CCc1cccc(NC(=O)N2CCc3nc(nc(-c4cccc(Cl)c4)c3C2)-c2cccnc2)c1
Show InChI InChI=1S/C27H24ClN5O/c1-2-18-6-3-10-22(14-18)30-27(34)33-13-11-24-23(17-33)25(19-7-4-9-21(28)15-19)32-26(31-24)20-8-5-12-29-16-20/h3-10,12,14-16H,2,11,13,17H2,1H3,(H,30,34)
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Similars
Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Merck Frosst Center for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at mouse P2Y14 expressed in human HEK cells coexpressing Galphai5 assessed as inhibition of UDP-glucose stimulated calcium releas...

Bioorg Med Chem Lett 21: 2832-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.084
BindingDB Entry DOI: 10.7270/Q20865N7
More data for this
Ligand-Target Pair