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BDBM50444481 CHEMBL3092633

SMILES: FC(F)(F)Oc1ccc(NC(=O)Nc2cccnc2Oc2ccccc2C2CCN(Cc3ccccc3)CC2)cc1

InChI Key: InChIKey=GTTXZQJMEXLDGZ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50444481   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Purinergic receptor P2Y1


(Homo sapiens (Human))		BDBM50444481
PNG
(CHEMBL3092633)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)Nc2cccnc2Oc2ccccc2C2CCN(Cc3ccccc3)CC2)cc1
Show InChI InChI=1S/C31H29F3N4O3/c32-31(33,34)41-25-14-12-24(13-15-25)36-30(39)37-27-10-6-18-35-29(27)40-28-11-5-4-9-26(28)23-16-19-38(20-17-23)21-22-7-2-1-3-8-22/h1-15,18,23H,16-17,19-21H2,(H2,36,37,39)
PDB

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Similars
Article
PubMed
 98n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Displacement of [beta-33P]-2MeS-ADP from human P2Y1 receptor transfected in HEK293 cells after 1 hr by scintillation counting method

Bioorg Med Chem Lett 23: 6825-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.009
BindingDB Entry DOI: 10.7270/Q2TQ630T
More data for this
Ligand-Target Pair