Ligand name: ISOPENICILLIN N
PDB ligand accession: IP1
DrugBank: DB03550
PubChem: 440723;25201752;
ChEMBL: n/a
InChI Key: MIFYHUACUWQUKT-GTQWGBSQSA-N
SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CCCC(C(=O)O)N)C(=O)O)C

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 IP1

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P05326_IP1	P05326	n/a