Ligand name: 2-ethyl-7-[(3S)-3-hydroxy-3-methylpyrrolidin-1-yl]-5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridine-6-carbonitrile
PDB ligand accession: A3J
DrugBank: n/a
PubChem: 129900196
ChEMBL: n/a
InChI Key: PSWIJUOHBAWLCU-HNNXBMFYSA-N
SMILES: CCc1cc2c([nH]1)c(c(c(n2)C(F)(F)F)C#N)N3CCC(C3)(C)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyridines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P50053

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5WBQ	Download	Experimental	e5wbqA1 e5wbqB1 e5wbqB1	Rossmann-like Rossmann-like Rossmann-like	LigPlot