BDBM50658558 MANADOSTEROL A

SMILES CC1=CC(C)(C)[C@@H](/C=C[C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H](OS(=O)(=O)[O-])[C@H]5C[C@H](O)[C@@H](OS(=O)(=O)[O-])C[C@]5(C)[C@H]4CC[C@]23C)[C@H]1CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](OS(=O)(=O)[O-])[C@H]4C[C@H](OS(=O)(=O)[O-])[C@@H](OS(=O)(=O)[O-])C[C@]4(C)[C@H]3CC[C@]12C

InChI Key InChIKey=JCCANDHWIGOKNS-UHFFFAOYSA-I

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 = 50658558   

TargetUbiquitin-conjugating enzyme E2 N(Human)
Universite de Caen Normandie

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50658558BDBM50658558(MANADOSTEROL A)
Affinity DataIC50: 90nMAssay Description:Inhibition of UBE2N (unknown origin)More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed