Ligand name: 2-methyl-2-(4-{2-[3-methyl-1-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl}-1H-pyrazol-1-yl)propanamide
PDB ligand accession: 799
DrugBank: DB12108
PubChem: 51001932
ChEMBL: CHEMBL2387080
InChI Key: BEUQXVWXFDOSAQ-UHFFFAOYSA-N
SMILES: Cc1nc(n(n1)C(C)C)c2cn3c(n2)-c4ccc(cc4OCC3)c5cnn(c5)C(C)(C)C(=O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Ethers

List of PDB structures and/or AlphaFold models with target protein O00329

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5T8F	Download	Experimental	e5t8fA2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot