PDB ligand accession: PIL
DrugBank: DB01791
PubChem:
ChEMBL:
InChI Key: RRRUXBQSQLKHEL-UHFFFAOYSA-N
SMILES: COc1ccc(cc1OC2CCCC2)C(=O)Nc3c(cncc3Cl)Cl
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | Q08499_PIL | Q08499 | inhibitor | IC50(nM) = 0.021 |
2 | Q8WQX9_PIL | Q8WQX9 | n/a | |
3 | P27815_PIL | P27815 | inhibitor | IC50(nM) = 1.6 |
4 | Q07343_PIL | Q07343 | inhibitor | Ki(nM) = 0.4 IC50(nM) = 0.041 |
5 | Q08493_PIL | Q08493 | n/a | IC50(nM) = 3.8 |