Ligand name: N-{(2S)-1-[4-(4-fluorophenyl)-3,6-dihydropyridin-1(2H)-yl]-1-oxopropan-2-yl}-2-[(9aR)-7-oxo-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridin-1-yl]acetamide
PDB ligand accession: 15S
DrugBank: n/a
PubChem: 137347936
ChEMBL: n/a
InChI Key: GXUDQLGOCXKORM-SBUREZEXSA-N
SMILES: CC(C(=O)N1CCC(=CC1)c2ccc(cc2)F)NC(=O)CN3CCc4cccc5c4C3CNC5=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein P09874

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4HHZ	Download	Experimental	e4hhzA1 e4hhzA2 e4hhzB1 e4hhzB2 e4hhzC1 e4hhzC2 e4hhzD3 e4hhzD4	Domain of poly(ADP-ribose) polymerase ADP-ribosylation Domain of poly(ADP-ribose) polymerase ADP-ribosylation Domain of poly(ADP-ribose) polymerase ADP-ribosylation ADP-ribosylation Domain of poly(ADP-ribose) polymerase	LigPlot