Ligand name: ~{N}-[2,4-bis(fluoranyl)-5-[[9-(2-morpholin-4-ylethylcarbamoyl)-11-oxidanylidene-5,6-dihydrodibenzo[1,2-~{d}:1',2'-~{f}][7]annulen-3-yl]amino]phenyl]thiophene-2-carboxamide
PDB ligand accession: 78L
DrugBank: n/a
PubChem: 137348574
ChEMBL: CHEMBL4061315
InChI Key: KAMAPKIQUKEGQC-UHFFFAOYSA-N
SMILES: c1cc(sc1)C(=O)Nc2cc(c(cc2F)F)Nc3ccc4c(c3)CCc5ccc(cc5C4=O)C(=O)NCCN6CCOCC6
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
5TBE	Download	Experimental	e5tbeA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot