PDB ligand accession: RBS
DrugBank: DB08462
PubChem:
ChEMBL:
InChI Key: JGWHILNNHLDARR-UHFFFAOYSA-N
SMILES: C=CC(=O)Nc1ccc2c(c1)c(ncn2)Nc3ccccc3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2HWO | Download | Experimental | e2hwoA1 e2hwoB1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |