BDBM50171448 (9BETA,14BETA,17BETA)-17-HYDROXY-2-METHOXYESTRA-1,3,5(10)-TRIEN-3-YL SULFAMATE::2-methoxyestradiol-3-O-sulfamate::CHEMBL190628::Sulfamic acid (11R,12S,15S,16S)-17-(S)-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester

SMILES COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1OS(N)(=O)=O

InChI Key InChIKey=RWIXFHUXVURZCZ-SSTWWWIQSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

  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 = 50171448   

TargetSteryl-sulfatase(Homo sapiens (Human))
University Of Bath

Curated by ChEMBL
LigandPNGBDBM50171448((9BETA,14BETA,17BETA)-17-HYDROXY-2-METHOXYESTRA-1,...)
Affinity DataIC50:  16nMAssay Description:Inhibition of steroid sulfatase-mediated coversion of [3H]E1S to E1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSteryl-sulfatase(Homo sapiens (Human))
University Of Bath

Curated by ChEMBL
LigandPNGBDBM50171448((9BETA,14BETA,17BETA)-17-HYDROXY-2-METHOXYESTRA-1,...)
Affinity DataIC50:  34nMAssay Description:Inhibitory concentration against steroid sulfatase in placental microsomesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed