BDBM50380222 CHEMBL2011420

SMILES: CN1c2cc3[C@H]4CC[C@@]5(C)[C@@H](CCC5=O)[C@@H]4CCc3cc2OS1(=O)=O

InChI Key: InChIKey=BTYGZCXDCRJNEM-QPWUGHHJSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50380222   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Steryl-sulfatase (Homo sapiens (Human))	BDBM50380222 (CHEMBL2011420) Show SMILES CN1c2cc3[C@H]4CC[C@@]5(C)[C@@H](CCC5=O)[C@@H]4CCc3cc2OS1(=O)=O |r| Show InChI InChI=1S/C19H23NO4S/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-17-16(10-14(11)12)20(2)25(22,23)24-17/h9-10,12-13,15H,3-8H2,1-2H3/t12-,13+,15-,19-/m0/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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibition of steroid sulfatase in human placental microsomes using [3H]E1S as substrate after 30 mins by scintillation spectrometry				Bioorg Med Chem 20: 2506-19 (2012) Article DOI: 10.1016/j.bmc.2012.03.007 BindingDB Entry DOI: 10.7270/Q2XG9S4J
					More data for this Ligand-Target Pair