Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb' and Ligand = 'BDBM228625'   

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 (Homo sapiens (Human))	BDBM228625 (US9345793, 6 | US9744252, Example 6) Show SMILES OC(=O)C[C@H](NC(=O)[C@@H]1CCCN(C1)C(=O)CCC1CCNCC1)c1cncc(c1)-c1cccc(OCCF)c1 |r| Show InChI InChI=1S/C30H39FN4O5/c31-10-14-40-26-5-1-3-22(16-26)24-15-25(19-33-18-24)27(17-29(37)38)34-30(39)23-4-2-13-35(20-23)28(36)7-6-21-8-11-32-12-9-21/h1,3,5,15-16,18-19,21,23,27,32H,2,4,6-14,17,20H2,(H,34,39)(H,37,38)/t23-,27+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
PIRAMAL IMAGING SA US Patent					Assay Description Purified human glycoprotein IIb/IIIa (20 mM Tris-HCl, 0.1 M NaCl, 0.1% Triton X-100, 1 mM CaCl2, 0.05% NaN3, 50% Glycerol, pH 7.4) was purchased from...				US Patent US9744252 (2017) BindingDB Entry DOI: 10.7270/Q2F76FN7
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