Ligand name: 4H-thieno[2,3-c]isoquinolin-5-one
PDB ligand accession: G18
DrugBank: n/a
PubChem: 9899130
ChEMBL: CHEMBL3108871
InChI Key: LQJVOLSLAFIXSV-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)-c3ccsc3NC2=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: Isoquinolones and derivatives

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
4AVW	Download	Experimental	e4avwA2 e4avwB2	ADP-ribosylation ADP-ribosylation	LigPlot
4PNR	Download	Experimental	e4pnrA1 e4pnrB1 e4pnrC1	ADP-ribosylation ADP-ribosylation ADP-ribosylation	LigPlot