Reaction Details | |||
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Target | Steryl-sulfatase | ||
Ligand | BDBM50134329 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_773110 (CHEMBL1839046) | ||
IC50 | 56±n/a nM | ||
Citation | Phan, CM; Liu, Y; Kim, BM; Mostafa, Y; Taylor, SD Inhibition of steroid sulfatase with 4-substituted estrone and estradiol derivatives. Bioorg Med Chem19:5999-6005 (2011) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Steryl-sulfatase | |||
Name: | Steryl-sulfatase | ||
Synonyms: | ARSC1 | ASC | Arylsulfatase C | STS | STS_HUMAN | Steroid sulfatase | Steryl-sulfate sulfohydrolase | ||
Type: | Enzyme | ||
Mol. Mass.: | 65503.66 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P08842 | ||
Residue: | 583 | ||
Sequence: |
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BDBM50134329 | |||
n/a | |||
Name | BDBM50134329 | ||
Synonyms: | CHEMBL122708 | Sulfamic acid (11R,12S,15S,16S)-13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester | Sulfamic acid (8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester | estra-1,3,5(10)-trien-17-one-3-sulphamate | estrone3-O-sulfamate | ||
Type | Small organic molecule | ||
Emp. Form. | C18H23NO4S | ||
Mol. Mass. | 349.445 | ||
SMILES | C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(N)(=O)=O)ccc34)[C@@H]1CCC2=O | ||
Structure |