BDBM50121116 CHEMBL3622021

SMILES [H][C@]12CC[C@]3(C)C(=O)N(CCC)C(=O)C[C@@]3([H])[C@]1([H])CCc1cc(OS(N)(=O)=O)ccc21

InChI Key InChIKey=JZYWURDDTHXMTI-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50121116   

TargetSteryl-sulfatase(Human)
University of Bath

Curated by ChEMBL
LigandPNGBDBM50121116(CHEMBL3622021)
Affinity DataIC50: 1nMAssay Description:Inhibition of STS activity in human placental microsome in presence of [3H]-estrone sulfateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2016
Entry Details Article
PubMed
TargetSteryl-sulfatase(Human)
University of Bath

Curated by ChEMBL
LigandPNGBDBM50121116(CHEMBL3622021)
Affinity DataIC50: 1nMAssay Description:Inhibition of human placental microsomal estrone sulfatase using [3H]E1S as substrate incubated for 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2017
Entry Details Article
PubMed