PDB ligand accession: 0SX
DrugBank: DB12357
PubChem: 57899889;135564632;
ChEMBL:
InChI Key: JJWLXRKVUJDJKG-VIFPVBQESA-N
SMILES: c1cc2c(cc1Cl)c3c(o2)C(=O)NC(=N3)C4CCCN4
Drug action: modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzofurans
- Subclass: None
- Class: Benzofurans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4F9C | Download | Experimental | e4f9cA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |