Ligand name: N-{2'-[(4-FLUOROPHENYL)AMINO]-4,4'-BIPYRIDIN-2-YL}-4-METHOXYCYCLOHEXANECARBOXAMIDE
PDB ligand accession: JNK
DrugBank: DB08025
PubChem: n/a
ChEMBL: CHEMBL203631
InChI Key: ACGBFWCBVIXTPZ-OQIWPSSASA-N
SMILES: COC1CCC(CC1)C(=O)Nc2cc(ccn2)c3ccnc(c3)Nc4ccc(cc4)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Bipyridines and oligopyridines

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P53779

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2EXC	Download	Experimental	e2excX1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot