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 = 'BDBM50162735'   

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 (Homo sapiens (Human))	BDBM50162735 (CHEMBL369574 | {2-[4-(4-But-2-ynyloxy-benzenesulfo...) Show SMILES CC#CCOc1ccc(cc1)S(=O)(=O)N1CCCN(CC1C(=O)NO)C(=O)CNC(=O)OC(C)(C)C Show InChI InChI=1S/C23H32N4O8S/c1-5-6-14-34-17-8-10-18(11-9-17)36(32,33)27-13-7-12-26(16-19(27)21(29)25-31)20(28)15-24-22(30)35-23(2,3)4/h8-11,19,31H,7,12-16H2,1-4H3,(H,24,30)(H,25,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory concentration against TNF-alpha converting enzyme at 1 uM				Bioorg Med Chem Lett 15: 1641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.01.053 BindingDB Entry DOI: 10.7270/Q2930SPX
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