Ligand name: 5-MERCAPTOETHANOL-2-DECENOYL-COENZYME A
PDB ligand accession: MDE
DrugBank: DB03698
PubChem: 49867291
ChEMBL: n/a
InChI Key: IJSMUHMCIYOVMM-UAQBTBCQSA-O
SMILES: CCCCCC(CC=CC(=O)SCCNC(=O)CCNC(C(=O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)[n+]2c[nH]c3c2ncnc3N)O)OP(=O)(O)O)O)SCC=O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine ribonucleotides

List of proteins that are targets for MDE

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P42593_MDE	P42593	n/a