Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb' and Ligand = 'BDBM228624'   

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))	BDBM228624 (US9345793, 5 | US9744252, Example 5) Show SMILES OC(=O)C[C@H](NC(=O)[C@@H]1CCCN(C1)C(=O)CCC1CCNCC1)c1cncc(OCCOCCOCCF)c1 |r| Show InChI InChI=1S/C28H43FN4O7/c29-7-11-38-12-13-39-14-15-40-24-16-23(18-31-19-24)25(17-27(35)36)32-28(37)22-2-1-10-33(20-22)26(34)4-3-21-5-8-30-9-6-21/h16,18-19,21-22,25,30H,1-15,17,20H2,(H,32,37)(H,35,36)/t22-,25+/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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