Ligand name: 4-{3-[(4-hydroxypiperidin-1-yl)acetyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzonitrile
PDB ligand accession: A8O
DrugBank: n/a
PubChem: 135393505
ChEMBL: CHEMBL5276142
InChI Key: WFOUOZGIXDMUJU-UHFFFAOYSA-N
SMILES: Cc1cc(c(n1c2ccc(cc2)C#N)C)C(=O)CN3CCC(CC3)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrroles
      • Subclass: Substituted pyrroles

List of PDB structures and/or AlphaFold models with target protein P54578

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6IIN	Download	Experimental	e6iinA1 e6iinB1	Cysteine proteinases-like Cysteine proteinases-like	LigPlot