Ligand name: 5-[(azetidin-3-yl)amino]-2-methyl-N-[(1R)-1-(3-{5-[(pyrrolidin-1-yl)methyl]thiophen-2-yl}phenyl)ethyl]benzamide
PDB ligand accession: XR8
DrugBank: n/a
PubChem: 155801618
ChEMBL: CHEMBL5083635
InChI Key: ZTKSBNLNPMUGBL-HXUWFJFHSA-N
SMILES: Cc1ccc(cc1C(=O)NC(C)c2cccc(c2)c3ccc(s3)CN4CCCC4)NC5CNC5
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P0DTC1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7LBS	Download	Experimental	e7lbsA1 e7lbsB1	Cysteine proteinases-like Cysteine proteinases-like	LigPlot