PDB ligand accession: EK7
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: AGUVBYOGMNUYPF-UHFFFAOYSA-N
SMILES: CN(C)c1c-2c(c(s1)C#N)CCc3c2nc(nc3)Nc4cccc(c4)O
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 |
---|---|---|---|---|---|
4FV4 | Download | Experimental | e4fv4A2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |