PDB ligand accession: 3U9
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GXUFIECYEKHMLD-SNVBAGLBSA-N
SMILES: CC(c1cc(ccc1OC)F)Oc2cc(cnc2N)c3cnnn3C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridyltriazoles
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4CNH | Download | Experimental | e4cnhA1 e4cnhB1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |