PDB ligand accession: NMX
DrugBank: DB04230
PubChem:
ChEMBL: n/a
InChI Key: PUGKTLRHGHIDCJ-GORZOVPNSA-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)NCCC[N+](=O)[O-])O
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine ribonucleotides
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
| # | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
|---|---|---|---|---|---|
| 1 | P23007_NMX | P23007 | Citrate synthase, mitochondrial | n/a | |
| 2 | O75390_NMX | O75390 | Citrate synthase, mitochondrial | n/a |