PDB ligand accession: 1UK
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: TVUPSIBSWDXJGQ-UHFFFAOYSA-N
SMILES: CC(=O)Nc1cn2cc(ccc2n1)c3cc(c(nc3)N)C(F)(F)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 |
---|---|---|---|---|---|
4KZC | Download | Experimental | e4kzcA3 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |