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BDBM260962 US9540323, 158::US9540323, example 158

SMILES: CC1(C)CN(c2c1c(c(F)cc2O)-c1ccc(nc1)C(F)(F)F)c1ccccc1NC(=O)Nc1nc2ccc(F)cc2s1

InChI Key: InChIKey=RKLHMDBVADLJHI-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260962   
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))		BDBM260962
PNG
(US9540323, 158 | US9540323, example 158)
Show SMILES CC1(C)CN(c2c1c(c(F)cc2O)-c1ccc(nc1)C(F)(F)F)c1ccccc1NC(=O)Nc1nc2ccc(F)cc2s1
Show InChI InChI=1S/C30H22F5N5O2S/c1-29(2)14-40(26-21(41)12-17(32)24(25(26)29)15-7-10-23(36-13-15)30(33,34)35)20-6-4-3-5-18(20)37-27(42)39-28-38-19-9-8-16(31)11-22(19)43-28/h3-13,41H,14H2,1-2H3,(H2,37,38,39,42)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 5.70 -11.2n/an/an/an/an/a7.425



Bristol-Myers Squibb Company

US Patent


Assay Description
A SPA membrane binding assay was used to identify inhibitors of [33P] 2MeS-ADP binding to cloned human P2Y1 receptors (The P2Y1 receptor membranes we...

US Patent US9540323 (2017)


BindingDB Entry DOI: 10.7270/Q289141P
More data for this
Ligand-Target Pair