Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50143878'   

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))	BDBM50143878 (2-Butoxycarbonylamino-5-[3-(4-carbamimidoyl-phenyl...) Show SMILES CCCCOC(=O)N[C@@H](CCC(=O)N1CCC2(CC1)N(C)C(=O)N(C2=O)c1ccc(cc1)C(N)=N)C(O)=O Show InChI InChI=1S/C25H34N6O7/c1-3-4-15-38-23(36)28-18(21(33)34)9-10-19(32)30-13-11-25(12-14-30)22(35)31(24(37)29(25)2)17-7-5-16(6-8-17)20(26)27/h5-8,18H,3-4,9-15H2,1-2H3,(H3,26,27)(H,28,36)(H,33,34)/t18-/m0/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	20	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Tested for inhibition of the binding of fibrinogen to purified human GPIIb-IIIa in a 96-well format (ELISA assay)				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143878 (2-Butoxycarbonylamino-5-[3-(4-carbamimidoyl-phenyl...) Show SMILES CCCCOC(=O)N[C@@H](CCC(=O)N1CCC2(CC1)N(C)C(=O)N(C2=O)c1ccc(cc1)C(N)=N)C(O)=O Show InChI InChI=1S/C25H34N6O7/c1-3-4-15-38-23(36)28-18(21(33)34)9-10-19(32)30-13-11-25(12-14-30)22(35)31(24(37)29(25)2)17-7-5-16(6-8-17)20(26)27/h5-8,18H,3-4,9-15H2,1-2H3,(H3,26,27)(H,28,36)(H,33,34)/t18-/m0/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	65	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of platelet aggregation induced by 20 microM adenosine 5-diphosphate (ADP) in citrated human platelet rich plasma (h-PRP)				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair