PDB ligand accession: FMW
DrugBank: DB15498
PubChem:
ChEMBL:
InChI Key: SGWLRDAOCLITOM-UHFFFAOYSA-N
SMILES: CCOc1cc(ccc1Nc2ncc3cc(nc(c3n2)NCC(C)(C)C)C)c4nncn4C
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Triazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6H3K | Download | Experimental | e6h3kA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |