Ligand name: 4-[3-(1,4-diazepan-1-ylcarbonyl)-4-fluorobenzyl]phthalazin-1(2H)-one
PDB ligand accession: KU8
DrugBank: DB08058
PubChem: 11291932
ChEMBL: CHEMBL380648
InChI Key: HGEPGGJUGUMFHT-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=NNC2=O)Cc3ccc(c(c3)C(=O)N4CCCNCC4)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazanaphthalenes
      • Subclass: Benzodiazines

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein Q9Y6F1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3C49	Download	Experimental	e3c49A2	ADP-ribosylation	LigPlot