Ligand name: (~{E})-2-cyano-~{N},~{N}-diethyl-3-[3-nitro-4,5-bis(oxidanyl)phenyl]prop-2-enamide
PDB ligand accession: PD9
DrugBank: DB00494
PubChem: 5281081
ChEMBL: CHEMBL953
InChI Key: JRURYQJSLYLRLN-BJMVGYQFSA-N
SMILES: CCN(CC)C(=O)C(=Cc1cc(c(c(c1)O)O)[N+](=O)[O-])C#N

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Cinnamic acids and derivatives
      • Subclass: Hydroxycinnamic acids and derivatives

List of proteins that are targets for PD9

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P21964_PD9	P21964	inhibitor
2	Q9C0B1_PD9	Q9C0B1	n/a	IC50(nM) = 3500.0