PDB ligand accession: JWE
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KARJFNUGCLEZKM-UHFFFAOYSA-N
SMILES: c1cc(nc2c1c(cnc2N)Br)c3ccnc(c3)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Bipyridines and oligopyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6RA5 | Download | Experimental | e6ra5A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |