PDB ligand accession: BYC
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: VEVJTUNLALKRNO-TYHXJLICSA-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)c4ccccc4)O
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Fatty Acyls
- Subclass: Fatty acyl thioesters
- Class: Fatty Acyls
- Superclass: Lipids and lipid-like molecules
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | Q9AIX7_BYC | Q9AIX7 | Benzoyl-CoA oxygenase component | n/a | |
2 | K9MST3_BYC | K9MST3 | BIS3 biphenyl synthase | n/a | |
3 | Q39TV8_BYC | Q39TV8 | Benzoyl-CoA reductase, putative | n/a | |
4 | P76077_BYC | P76077 | 1,2-phenylacetyl-CoA epoxidase, subunit | n/a | |
5 | Q2KIR7_BYC | Q2KIR7 | Glycine N-acyltransferase (EC | n/a |