Ligand name: (2E)-3-[(4-hydroxy-2-oxobutyl)amino]prop-2-enal
PDB ligand accession: ISS
DrugBank: n/a
PubChem: 444594
ChEMBL: n/a
InChI Key: WWFGWBHKRFILGQ-HNQUOIGGSA-N
SMILES: C(CO)C(=O)CNC=CC=O

ClassyFire chemical classification:

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

List of proteins that are targets for ISS

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P0C5C1_ISS	P0C5C1	Beta-lactamase (EC 3.5.2.6)	n/a
2	C8CP57_ISS	C8CP57	Beta-lactamase (EC 3.5.2.6)	n/a
3	A0A0T9EA39_ISS	A0A0T9EA39	deleted	n/a
4	Q59648_ISS	Q59648	Beta-lactamase (EC 3.5.2.6)	n/a