Ligand name: (2E)-N-[(1S)-1-[5-chloro-4-(4-hydroxy-2-oxo-1,2-dihydroquinolin-6-yl)-1H-imidazol-2-yl]-3-(4-methylpiperazin-1-yl)-3-oxopropyl]-3-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]prop-2-enamide
PDB ligand accession: 4CE
DrugBank: n/a
PubChem: 77108442
ChEMBL: CHEMBL3580759
InChI Key: NBMJTOOHXJGJNZ-RJOTYRNVSA-N
SMILES: CN1CCN(CC1)C(=O)CC(c2[nH]c(c(n2)c3ccc4c(c3)C(=CC(=O)N4)O)Cl)NC(=O)C=Cc5cc(ccc5n6cnnn6)Cl

ClassyFire chemical classification:

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

List of proteins that are targets for 4CE

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P03951_4CE	P03951	n/a