PDB ligand accession: ET1
DrugBank: DB07724
PubChem:
ChEMBL:
InChI Key: YMPALHOKRBVHOJ-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)S(=O)(=O)n2cc(c3c2ccc(c3)OC)CCC(=O)O
Drug action: agonist
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolyl carboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3ET2 | Download | Experimental | e3et2A1 e3et2B1 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |