PDB ligand accession: P16
DrugBank: DB08339
PubChem:
ChEMBL:
InChI Key: ZIQFYVPVJZEOFS-UHFFFAOYSA-N
SMILES: CN1c2c(cnc(n2)Nc3cccc(c3)CO)C=C(C1=O)c4c(cccc4Cl)Cl
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P00519-2_P16 | P00519-2 | n/a | |
2 | P00519_P16 | P00519 | inhibitor | IC50(nM) = 2.8 |
3 | P00520_P16 | P00520 | n/a |