Ligand name: N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzene-1-carbonyl}-L-phenylalanine
PDB ligand accession: JBG
DrugBank: n/a
PubChem: 58647174
ChEMBL: n/a
InChI Key: XEBIFCYTYHBFTB-SFHVURJKSA-N
SMILES: CN1CCN(CC1)CCOc2c(cc(c(c2Cl)O)C(=O)NC(Cc3ccccc3)C(=O)O)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q9UKF6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6M8Q	Download	Experimental	e6m8qA1 e6m8qA2 e6m8qB1 e6m8qB2	Metallo-hydrolase/oxidoreductase P-loop domains-like P-loop domains-like Metallo-hydrolase/oxidoreductase	LigPlot