BDBM119430 US8669266, 600

SMILES: CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCc1nnn[nH]1)NC(=O)c1cc(OCC(=O)N2CCC[C@H]2C(=O)NC2CCC2)c2ccc(C)cc2n1

InChI Key: InChIKey=KXBOXRFDFHPCAB-WNJJXGMVSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 119430   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Purinergic receptor P2Y12 (Homo sapiens (Human))	BDBM119430 (US8669266, 600) Show SMILES CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCc1nnn[nH]1)NC(=O)c1cc(OCC(=O)N2CCC[C@H]2C(=O)NC2CCC2)c2ccc(C)cc2n1 Show InChI InChI=1S/C36H48N10O7/c1-3-4-19-52-36(51)45-17-15-44(16-18-45)35(50)26(12-13-31-40-42-43-41-31)39-33(48)28-21-30(25-11-10-23(2)20-27(25)38-28)53-22-32(47)46-14-6-9-29(46)34(49)37-24-7-5-8-24/h10-11,20-21,24,26,29H,3-9,12-19,22H2,1-2H3,(H,37,49)(H,39,48)(H,40,41,42,43)/t26-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description The ability of a test compound to bind to the P2Y12 receptor was evaluated in a recombinant cell membrane binding assay. In this competitive binding ...				US Patent US8669266 (2014) BindingDB Entry DOI: 10.7270/Q2DJ5D9R
					More data for this Ligand-Target Pair