Ligand name: S-4-NITROBUTYRYL-COA
PDB ligand accession: NBC
DrugBank: DB03245
PubChem: 448575
ChEMBL: n/a
InChI Key: PXNIOQHGCSEKCC-CITAKDKDSA-N
SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CCC[N+](=O)[O-])O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Fatty Acyls
      • Subclass: Fatty acyl thioesters

List of proteins that are targets for NBC

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	Q92947_NBC	Q92947	n/a