Ligand name: ~{N}-methyl-1-(3-thiophen-3-ylphenyl)methanamine
PDB ligand accession: 5VA
DrugBank: n/a
PubChem: 18525825
ChEMBL: CHEMBL3780738
InChI Key: SNXSVYZFYWVLHK-UHFFFAOYSA-N
SMILES: CNCc1cccc(c1)c2ccsc2
Drug action: n/a

ClassyFire chemical classification:

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

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
7S1C	Download	Experimental	e7s1cA2 e7s1cB1 e7s1cB2	Thioredoxin-like Thioredoxin-like Insertion subdomain in DsbA-like	LigPlot