Ligand name: 7-[(4-methylpiperazin-1-yl)methyl]-4-[(3-methyl-1H-pyrazol-5-yl)amino]-2-(tetrahydro-2H-pyran-4-yl)phthalazin-1(2H)-one
PDB ligand accession: 614
DrugBank: n/a
PubChem: 46174168
ChEMBL: n/a
InChI Key: IYIPJBAPGVUHNG-UHFFFAOYSA-N
SMILES: Cc1cc([nH]n1)NC2=NN(C(=O)c3c2ccc(c3)CN4CCN(CC4)C)C5CCOCC5
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q08881

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3MJ1	Download	Experimental	e3mj1A2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot