Ligand name: N-{(3R,6S,9S,12R)-6-ethyl-12-methyl-9-[3-(N'-methylcarbamimidamido)propyl]-2,5,8,11-tetraoxo-3-phenyl-1,4,7,10-tetraazacyclotetradecan-12-yl}-2-methylpropanamide
PDB ligand accession: 9BA
DrugBank: n/a
PubChem: 129010138
ChEMBL: CHEMBL4116919
InChI Key: ZAIPJVQTYUSDTG-LDFBIXNTSA-N
SMILES: CCC1C(=O)NC(C(=O)NCCC(C(=O)NC(C(=O)N1)CCCNC(=N)NC)(C)NC(=O)C(C)C)c2ccccc2

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of proteins that are targets for 9BA

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P61964_9BA	P61964	n/a