Ligand name: N~2~-{4-[6-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)-1H-benzimidazol-1-yl]-6-ethoxy-1,3,5-triazin-2-yl}-3-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-N-methyl-L-alaninamide
PDB ligand accession: 5JZ
DrugBank: n/a
PubChem: 42640803
ChEMBL: CHEMBL1213155
InChI Key: IIOQBYZRVQSNSJ-MHZLTWQESA-N
SMILES: CCOc1nc(nc(n1)n2cnc3c2cc(cc3)C(=O)N4CCCc5c4cccc5)NC(Cc6ccc7c(c6)COC(O7)(C)C)C(=O)NC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HA8	Download	Experimental	e3ha8A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot