Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50286531'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50286531 (3-{[9-Methyl-1-oxo-2-(2-piperidin-4-yl-ethyl)-2,3,...) Show SMILES Cc1c(cn2CCCN(CCC3CCNCC3)C(=O)c12)C(=O)NCCC(O)=O Show InChI InChI=1S/C20H30N4O4/c1-14-16(19(27)22-9-5-17(25)26)13-24-11-2-10-23(20(28)18(14)24)12-6-15-3-7-21-8-4-15/h13,15,21H,2-12H2,1H3,(H,22,27)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of fibrinogen binding to glycoprotein alpha IIb beta3 integrin of activated platelets				Bioorg Med Chem Lett 5: 475-480 (1995) Article DOI: 10.1016/0960-894X(95)00057-Z BindingDB Entry DOI: 10.7270/Q2N879RH
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