PDB ligand accession: 4HV
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WYLRQKDQMNFNCH-LJQANCHMSA-N
SMILES: COc1ccc(cc1OC)c2cc(co2)C(=O)NC(Cc3cccc(c3)C#N)CO
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenethylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | P55212_4HV | P55212 | Caspase-6 (CASP-6) (CSP-6) | n/a |