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BDBM260965 US9540323, 162::US9540323, example 162

SMILES: CC1(C)CN(c2c1c(c(F)cc2O)-c1ccc(Cl)cn1)c1ccccc1NC(=O)Nc1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=CDSXTTYOKDIPKK-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 260965   
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))		BDBM260965
PNG
(US9540323, 162 | US9540323, example 162)
Show SMILES CC1(C)CN(c2c1c(c(F)cc2O)-c1ccc(Cl)cn1)c1ccccc1NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C29H23ClF4N4O3/c1-28(2)15-38(26-23(39)13-19(31)24(25(26)28)21-12-7-16(30)14-35-21)22-6-4-3-5-20(22)37-27(40)36-17-8-10-18(11-9-17)41-29(32,33)34/h3-14,39H,15H2,1-2H3,(H2,36,37,40)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 6.40 -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