Ligand name: (1R)-9-[(1,3-dimethylazetidin-3-yl)(methyl)amino]-1-methyl-8-phenyl-3,5-dihydro[1,2,4]triazino[3,4-c][1,4]benzoxazin-2(1H)-one
PDB ligand accession: 3L0
DrugBank: n/a
PubChem: 76286478
ChEMBL: CHEMBL3355117
InChI Key: RGCJJZQGWXZHJQ-OAHLLOKOSA-N
SMILES: CC1C(=O)NN=C2N1c3cc(c(cc3OC2)c4ccccc4)N(C)C5(CN(C5)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzoxazines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q04759

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4RA5	Download	Experimental	e4ra5A1 e4ra5B1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot