Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Steryl-sulfatase' and Ligand = 'BDBM50116183'   

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))	BDBM50116183 (CHEMBL3612349) Show SMILES OP(=S)(Oc1ccc2c3CCCCCc3c(=O)oc2c1)Oc1ccc2c3CCCCCc3c(=O)oc2c1 Show InChI InChI=1S/C28H27O7PS/c29-27-23-9-5-1-3-7-19(23)21-13-11-17(15-25(21)32-27)34-36(31,37)35-18-12-14-22-20-8-4-2-6-10-24(20)28(30)33-26(22)16-18/h11-16H,1-10H2,(H,31,37)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of human placenta STS using NPS as substrate after 15 mins by microplate reader analysis				Eur J Med Chem 101: 358-66 (2015) Article DOI: 10.1016/j.ejmech.2015.06.051 BindingDB Entry DOI: 10.7270/Q29C706J
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