Ligand name: isoquinolin-1(2H)-one
PDB ligand accession: 4YS
DrugBank: n/a
PubChem: 10284;5280918;
ChEMBL: CHEMBL339695
InChI Key: VDBNYAPERZTOOF-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C=CNC2=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 P0DTD1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5RUI	Download	Experimental	e5ruiA1	Macro domain-like	LigPlot