Ligand name: 2-[2-(2-METHYL-2,3-DIHYDRO-INDOL-1-YL)-2-OXO-ETHYL]-6-MORPHOLIN-4-YL-3H-PYRIMIDIN-4-ONE
PDB ligand accession: J82
DrugBank: n/a
PubChem: 49854424;135565159;
ChEMBL: CHEMBL3112866
InChI Key: UAXHPOBBKRWJGA-ZDUSSCGKSA-N
SMILES: CC1Cc2ccccc2N1C(=O)CC3=NC(=CC(=O)N3)N4CCOCC4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q8BTI9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4BFR	Download	Experimental	e4bfrA1 e4bfrB4	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot