PDB ligand accession: 7R3
DrugBank: DB09038
PubChem:
ChEMBL:
InChI Key: OBWASQILIWPZMG-QZMOQZSNSA-N
SMILES: c1cc(ccc1Cc2cc(ccc2Cl)C3C(C(C(C(O3)CO)O)O)O)OC4CCOC4
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbohydrates and carbohydrate conjugates
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P31639_7R3 | P31639 | inhibitor | IC50(nM) = 3.1 EC50(nM) = 3.0 |
2 | P16219_7R3 | P16219 | n/a |