Ligand name: 2-GUANIDINO-4-METHYL-PENTANOIC ACID [2-(4-{5-[4-(4-ACETYLAMINO-BENZYLOXY)-2,3-DICHLORO-PHENYL]-2-METHYL-2H-PYRAZOL-3-YL}-PIPERIDIN-1-YL)-2-OXO-ETHYL]-AMIDE
PDB ligand accession: FRI
DrugBank: DB02555
PubChem: 656989
ChEMBL: n/a
InChI Key: VCXMTWSYQSVWRK-AREMUKBSSA-N
SMILES: CC(C)CC(C(=O)NCC(=O)N1CCC(CC1)c2cc(nn2C)c3ccc(c(c3Cl)Cl)OCc4ccc(cc4)NC(=O)C)NC(=N)N
Drug action: inhibitor

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 P60568

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1QVN	Download	Experimental	e1qvnA1 e1qvnC1 e1qvnB1 e1qvnC1 e1qvnD1	Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines Ferritin/Heme oxygenase/4-helical cytokines	LigPlot