Ligand name: 5-CYANO-FURAN-2-CARBOXYLIC ACID [5-HYDROXYMETHYL-2-(4-METHYL-PIPERIDIN-1-YL)-PHENYL]-AMIDE
PDB ligand accession: 5CN
DrugBank: DB07167
PubChem: 9884318
ChEMBL: CHEMBL400754
InChI Key: NNPCFFIJVKYGHR-UHFFFAOYSA-N
SMILES: CC1CCN(CC1)c2ccc(cc2NC(=O)c3ccc(o3)C#N)CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Anilides

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P07333

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2I1M	Download	Experimental	e2i1mA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
2I0Y	Download	Experimental	e2i0yA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot