Ligand name: 5-{[(2-aminoethyl)sulfanyl]methyl}furan-2-carbaldehyde
PDB ligand accession: 3EC
DrugBank: n/a
PubChem: 137348142
ChEMBL: n/a
InChI Key: IXLKFYGLYDVEMS-UHFFFAOYSA-N
SMILES: c1cc(oc1CSCCN)C=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein Q8I4W8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4R1E	Download	Experimental	e4r1eA1 e4r1eA2	EF-hand EF-hand	LigPlot