Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Disintegrin and metalloproteinase domain-containing protein 17' and Ligand = 'BDBM50216007'   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Sus scrofa (pig))	BDBM50216007 (CHEMBL393443 | tert-butyl 4-(4-((2-methylquinolin-...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(Cc3n[nH]c(=S)[nH]3)CCN(CC2)C(=O)OC(C)(C)C)c2ccccc2n1 Show InChI InChI=1S/C31H36N6O4S/c1-20-17-22(24-7-5-6-8-25(24)32-20)19-40-23-11-9-21(10-12-23)27(38)34-31(18-26-33-28(42)36-35-26)13-15-37(16-14-31)29(39)41-30(2,3)4/h5-12,17H,13-16,18-19H2,1-4H3,(H,34,38)(H2,33,35,36,42)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of porcine TACE				Bioorg Med Chem Lett 17: 4678-82 (2007) Article DOI: 10.1016/j.bmcl.2007.05.100 BindingDB Entry DOI: 10.7270/Q2H41R4X
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