BDBM50307708 (4S)5-[4-(Butoxycarbonyl)piperazin-1-yl]-5-oxo-4-({[6-phenyl-4-(2-piperidin-3-ylethoxy)pyridin-2-yl]carbonyl}amino)pentanoicAcid::CHEMBL592577

SMILES: CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(OCCC2CCCNC2)cc(n1)-c1ccccc1

InChI Key: InChIKey=OZNPRKONZQGMHJ-WKDCXCOVSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50307708   

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))	BDBM50307708 ((4S)5-[4-(Butoxycarbonyl)piperazin-1-yl]-5-oxo-4-(...) Show SMILES CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(OCCC2CCCNC2)cc(n1)-c1ccccc1 |r| Show InChI InChI=1S/C33H45N5O7/c1-2-3-19-45-33(43)38-17-15-37(16-18-38)32(42)27(11-12-30(39)40)36-31(41)29-22-26(44-20-13-24-8-7-14-34-23-24)21-28(35-29)25-9-5-4-6-10-25/h4-6,9-10,21-22,24,27,34H,2-3,7-8,11-20,23H2,1H3,(H,36,41)(H,39,40)/t24?,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research& Development Curated by ChEMBL					Assay Description Displacement of [33P]ADP from human recombinant P2Y12 receptor expressed in CHO cells				J Med Chem 53: 2010-37 (2010) Article DOI: 10.1021/jm901518t BindingDB Entry DOI: 10.7270/Q2HH6K50
					More data for this Ligand-Target Pair