Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50435612'   

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))	BDBM50435612 (CHEMBL2391036) Show SMILES OC(=O)C1CCN(CC1)c1ccc(cc1)N1C[C@@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C21H22ClN3O5S/c22-18-6-5-17(31-18)19(26)23-11-16-12-25(21(29)30-16)15-3-1-14(2-4-15)24-9-7-13(8-10-24)20(27)28/h1-6,13,16H,7-12H2,(H,23,26)(H,27,28)/t16-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Displacement of biotinylated fibrinogen from human glycoprotein 2b/3a receptor after 2 hrs by chemiluminescence assay				Eur J Med Chem 64: 302-13 (2013) Article DOI: 10.1016/j.ejmech.2013.03.056 BindingDB Entry DOI: 10.7270/Q2Q241N8
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