Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Steryl-sulfatase' and Ligand = 'BDBM50370417'   

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
Steryl-sulfatase (Homo sapiens (Human))	BDBM50370417 (CHEMBL1627727) Show SMILES CC(C)(C)OC(=O)NCC(=O)Oc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CCc2c1 Show InChI InChI=1S/C25H33NO5/c1-24(2,3)31-23(29)26-14-22(28)30-16-6-8-17-15(13-16)5-7-19-18(17)11-12-25(4)20(19)9-10-21(25)27/h6,8,13,18-20H,5,7,9-12,14H2,1-4H3,(H,26,29)/t18-,19-,20+,25+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research GDC Curated by ChEMBL					Assay Description Inhibition of purified human steroid sulfatase				Bioorg Med Chem Lett 14: 4999-5002 (2004) Article DOI: 10.1016/j.bmcl.2004.07.013 BindingDB Entry DOI: 10.7270/Q2Z89D64
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