PDB ligand accession: BBI
DrugBank: DB01118
PubChem:
ChEMBL:
InChI Key: IYIKLHRQXLHMJQ-UHFFFAOYSA-N
SMILES: CCCCc1c(c2ccccc2o1)C(=O)c3cc(c(c(c3)I)OCCN(CC)CC)I
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | Q9P0X4_BBI | Q9P0X4 | inhibitor | |
2 | Q86YN6_BBI | Q86YN6 | agonist | |
3 | Q07869_BBI | Q07869 | agonist | |
4 | Q9NTG7_BBI | Q9NTG7 | n/a | EC50(nM) = 3250.0 |
5 | P37231_BBI | P37231 | agonist |