PDB ligand accession: DQX
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: IBPVXAOOVUAOKJ-UHFFFAOYSA-N
SMILES: c1cc(c2c(c1)ncc(n2)c3cnn(c3)C4CCNCC4)c5cc(c(c(c5)F)CN6CCOCC6)F
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 |
---|---|---|---|---|---|
5UT4 | Download | Experimental | e5ut4A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
3KRR | Download | Experimental | e3krrA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |