Ligand name: TAK-715
PDB ligand accession: T75
DrugBank: DB16108
PubChem: 9952773
ChEMBL: CHEMBL363648
InChI Key: HEKAIDKUDLCBRU-UHFFFAOYSA-N
SMILES: CCc1nc(c(s1)c2ccnc(c2)NC(=O)c3ccccc3)c4cccc(c4)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

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
6ANL	Download	Experimental	e6anlA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
3ZSG	Download	Experimental	e3zsgA2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot