Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50060308'   

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))	BDBM50060308 (CHEMBL115191 | {4-[4-(4-Carbamimidoyl-phenyl)-thia...) Show SMILES NC(=N)c1ccc(cc1)-c1csc(NC2CCN(CC(O)=O)CC2)n1 Show InChI InChI=1S/C17H21N5O2S/c18-16(19)12-3-1-11(2-4-12)14-10-25-17(21-14)20-13-5-7-22(8-6-13)9-15(23)24/h1-4,10,13H,5-9H2,(H3,18,19)(H,20,21)(H,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi Recherche Curated by ChEMBL					Assay Description In vitro inhibition of ADP-induced (2.5 microM) human platelet aggregation.				J Med Chem 40: 3393-401 (1997) Article DOI: 10.1021/jm970240y BindingDB Entry DOI: 10.7270/Q2FX78J3
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50060308 (CHEMBL115191 | {4-[4-(4-Carbamimidoyl-phenyl)-thia...) Show SMILES NC(=N)c1ccc(cc1)-c1csc(NC2CCN(CC(O)=O)CC2)n1 Show InChI InChI=1S/C17H21N5O2S/c18-16(19)12-3-1-11(2-4-12)14-10-25-17(21-14)20-13-5-7-22(8-6-13)9-15(23)24/h1-4,10,13H,5-9H2,(H3,18,19)(H,20,21)(H,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi Recherche Curated by ChEMBL					Assay Description In vitro inhibition of ADP-induced (2.5 microM) human platelet aggregation.				J Med Chem 40: 3393-401 (1997) Article DOI: 10.1021/jm970240y BindingDB Entry DOI: 10.7270/Q2FX78J3
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50060308 (CHEMBL115191 | {4-[4-(4-Carbamimidoyl-phenyl)-thia...) Show SMILES NC(=N)c1ccc(cc1)-c1csc(NC2CCN(CC(O)=O)CC2)n1 Show InChI InChI=1S/C17H21N5O2S/c18-16(19)12-3-1-11(2-4-12)14-10-25-17(21-14)20-13-5-7-22(8-6-13)9-15(23)24/h1-4,10,13H,5-9H2,(H3,18,19)(H,20,21)(H,23,24)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi Recherche Curated by ChEMBL					Assay Description In vitro inhibition of ADP-induced (2.5 microM) baboon platelet aggregation.				J Med Chem 40: 3393-401 (1997) Article DOI: 10.1021/jm970240y BindingDB Entry DOI: 10.7270/Q2FX78J3
					More data for this Ligand-Target Pair