Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50034698'   

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))	BDBM50034698 (3-{[1-((R)-2-tert-Butoxycarbonylamino-5-guanidino-...) Show SMILES CC(C)(C)OC(=O)N[C@H](CCCNC(N)=N)C(=O)N1CCCC(C1)C(=O)NCCC(O)=O Show InChI InChI=1S/C20H36N6O6/c1-20(2,3)32-19(31)25-14(7-4-9-24-18(21)22)17(30)26-11-5-6-13(12-26)16(29)23-10-8-15(27)28/h13-14H,4-12H2,1-3H3,(H,23,29)(H,25,31)(H,27,28)(H4,21,22,24)/t13?,14-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of biotinylated fibrinogen binding to isolated alpha IIb beta3 integrin				J Med Chem 38: 1582-92 (1995) BindingDB Entry DOI: 10.7270/Q2GB233R
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