PDB ligand accession: 9UO
DrugBank: DB17097
PubChem:
ChEMBL:
InChI Key: QCZAWDGAVJMPTA-RNFRBKRXSA-N
SMILES: CC(C(F)(F)F)Nc1nc(nc(n1)NC(C)C(F)(F)F)c2cccc(n2)Cl
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Triazines
- Subclass: Aminotriazines
- Class: Triazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6VFZ | Download | Experimental | e6vfzA2 e6vfzB2 | Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like | LigPlot |
6ADI | Download | Experimental | e6adiA2 e6adiB2 | Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like | LigPlot |