Ligand name: 3-chloro-4-(4-methyl-2-oxo-1,2-dihydroquinolin-7-yl)-N-[2-(morpholin-4-yl)ethyl]benzamide
PDB ligand accession: AJ7
DrugBank: n/a
PubChem: 71576802
ChEMBL: CHEMBL2381638
InChI Key: QJNFNCVAIRRBKM-UHFFFAOYSA-N
SMILES: CC1=CC(=O)Nc2c1ccc(c2)c3ccc(cc3Cl)C(=O)NCCN4CCOCC4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Phenylquinolines

List of PDB structures and/or AlphaFold models with target protein Q9H2K2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4J22	Download	Experimental	e4j22A1 e4j22B1	ADP-ribosylation ADP-ribosylation	LigPlot