Ligand name: (2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]phenyl}carbonyl)amino]methyl}benzyl)butanoic acid
PDB ligand accession: S44
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: GUFHDBFHNDUDJA-ZQPQWVRXSA-N
SMILES: CCCOc1ccc(cc1CNC(=O)c2ccc(cc2)C34CC5CC(C3)CC(C5)C4)CC(CC)C(=O)O

ClassyFire chemical classification:

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

List of proteins that are targets for S44

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	Q07869_S44	Q07869	n/a
2	P37231_S44	P37231	n/a