Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50083833'   

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))	BDBM50083833 (3-({1-[3-(1H-Imidazol-2-ylamino)-propyl]-1H-indazo...) Show SMILES Cc1ccc(cc1)S(=O)(=O)N[C@@H](CNC(=O)c1ccc2n(CCCNc3ncc[nH]3)ncc2c1)C(O)=O Show InChI InChI=1S/C24H27N7O5S/c1-16-3-6-19(7-4-16)37(35,36)30-20(23(33)34)15-28-22(32)17-5-8-21-18(13-17)14-29-31(21)12-2-9-25-24-26-10-11-27-24/h3-8,10-11,13-14,20,30H,2,9,12,15H2,1H3,(H,28,32)(H,33,34)(H2,25,26,27)/t20-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of aggregation of human gel-purified platelets (GPIIbIIIa GPP)				J Med Chem 43: 41-58 (2000) BindingDB Entry DOI: 10.7270/Q21G0KG2
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