Ligand name: 1-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]-2,2-dimethylpropan-1-one
PDB ligand accession: M5J
DrugBank: n/a
PubChem: 92485003
ChEMBL: n/a
InChI Key: KAKAXRVKJWUSTC-ZDUSSCGKSA-N
SMILES: CC(C)(C)C(=O)N1CCCC1c2cccc(c2)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolidines
      • Subclass: Phenylpyrrolidines

List of PDB structures and/or AlphaFold models with target protein Q13546

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6OCQ	Download	Experimental	e6ocqA1 e6ocqB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot