PDB ligand accession: 0FN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GKEKUQYTCADDSQ-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=O)C(C2=O)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Indanes
- Subclass: Indanones
- Class: Indanes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3VBW | Download | Experimental | e3vbwA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |