PDB ligand accession: LIA
DrugBank: DB08094
PubChem:
ChEMBL:
InChI Key: JRNJNYBQQYBCLE-UHFFFAOYSA-N
SMILES: COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2FVD | Download | Experimental | e2fvdA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |