Ligand name: (azepan-1-yl)(2-{[(furan-2-yl)methyl]amino}-6-methylpyridin-3-yl)methanone
PDB ligand accession: 74Y
DrugBank: n/a
PubChem: 59625393
ChEMBL: CHEMBL3919906
InChI Key: JCTPWJNVLSRFOU-UHFFFAOYSA-N
SMILES: Cc1ccc(c(n1)NCc2ccco2)C(=O)N3CCCCCC3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Pyridinecarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P00797

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5SZ9	Download	Experimental	e5sz9A1 e5sz9A2 e5sz9B1 e5sz9B2	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot