BDBM50070335 CHEMBL280972::Thiophene-2-sulfonic acid [2-(3-{[((E)-6,6-dimethyl-hept-2-en-4-ynyl)-ethyl-amino]-methyl}-phenoxy)-ethyl]-amide

SMILES CCN(C\C=C\C#CC(C)(C)C)Cc1cccc(OCCNS(=O)(=O)c2cccs2)c1

InChI Key InChIKey=KGMBJTRITPWSKL-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50070335   

TargetSqualene monooxygenase(Human)
Centre De Recherche Pierre Fabre

Curated by ChEMBL
LigandPNGBDBM50070335(Thiophene-2-sulfonic acid [2-(3-{[((E)-6,6-dimethy...)
Affinity DataIC50: 450nMAssay Description:In vitro inhibition of pig liver squalene epoxidase in HepG2 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed