Ligand name: 7-[(3S,4R)-4-[4-(trifluoromethyl)phenyl]carbonylpyrrolidin-3-yl]-3H-quinazolin-4-one
PDB ligand accession: S3N
DrugBank: n/a
PubChem: 118986992;135566976;
ChEMBL: n/a
InChI Key: XZRRVVLAMWXVRY-CVEARBPZSA-N
SMILES: c1cc(ccc1C(=O)C2CNCC2c3ccc4c(c3)N=CNC4=O)C(F)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein P17612

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4UJ9	Download	Experimental	e4uj9A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot