PDB ligand accession: 4ZR
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: BOPSHQJEVUOWPS-LMOYCYGVSA-N
SMILES: CC(c1nc2cnc(cc2n1C(C)C(F)(F)F)Nc3ccnc(n3)N4CCC(C(C4)F)OC)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Imidazopyridines
- Subclass: Imidazo-[4,5-c]pyridines
- Class: Imidazopyridines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5CAU | Download | Experimental | e5cauA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |