Ligand name: 2-AMINO-PHENYLAMINO-DIBENZOSUBERONE
PDB ligand accession: 2A8
DrugBank: n/a
PubChem: 11955788
ChEMBL: CHEMBL218962
InChI Key: VMANCBCSTYKPPA-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)CCc3cc(ccc3C2=O)Nc4ccccc4N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Dibenzocycloheptenes
      • Subclass: None

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
3ZYA	Download	Experimental	e3zyaA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot