Ligand name: 2-methyl-4-{4-[2-(morpholin-4-yl)-2-oxoethyl]phenoxy}benzonitrile
PDB ligand accession: O6Y
DrugBank: n/a
PubChem: 146027014
ChEMBL: CHEMBL4641779
InChI Key: QOJWBEUMAJACBY-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1C#N)Oc2ccc(cc2)CC(=O)N3CCOCC3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Diphenylethers

List of PDB structures and/or AlphaFold models with target protein P0AEG4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6PBI	Download	Experimental	e6pbiA2 e6pbiB1 e6pbiB2	Thioredoxin-like Thioredoxin-like Insertion subdomain in DsbA-like	LigPlot
6PG2	Download	Experimental	e6pg2A1 e6pg2B2	Thioredoxin-like Thioredoxin-like	LigPlot