PDB ligand accession: IU5
DrugBank: DB01586
PubChem:
ChEMBL:
InChI Key: RUDATBOHQWOJDD-DNMBCGTGSA-N
SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Bile acids, alcohols and derivatives
- Class: Steroids and steroid derivatives
- Superclass: Lipids and lipid-like molecules
| # | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
|---|---|---|---|---|---|
| 1 | P52895_IU5 | P52895 | Aldo-keto reductase family | inhibitor | |
| 2 | Q62735_IU5 | Q62735 | Bile acid receptor | n/a |