PDB ligand accession: JGB
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: USOXQZNJFMKTKJ-XVNBXDOJSA-N
SMILES: c1cc(c(cc1C=C(C#N)C(=O)N)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Cinnamic acids and derivatives
- Subclass: Hydroxycinnamic acids and derivatives
- Class: Cinnamic acids and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6QS5 | Download | Experimental | e6qs5A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |