PDB ligand accession: GW6
DrugBank: DB08906
PubChem:
ChEMBL:
InChI Key: XTULMSXFIHGYFS-VLSRWLAYSA-N
SMILES: CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)SCF)OC(=O)c5ccco5)C)O)F)C)F
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Steroid esters
- Class: Steroids and steroid derivatives
- Superclass: Lipids and lipid-like molecules
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P06401_GW6 | P06401 | agonist | IC50(nM) = 21.0 |
2 | P08235_GW6 | P08235 | antagonist | IC50(nM) = 166.0 EC50(nM) = 3000.0 |
3 | P04150_GW6 | P04150 | agonist | Ki(nM) = 0.51 IC50(nM) = 0.0398 EC50(nM) = 0.4 |