PDB ligand accession: L5G
DrugBank: DB08079
PubChem:
ChEMBL:
InChI Key: HEAIZQNMNCHNFD-UHFFFAOYSA-N
SMILES: COc1ccc2c(ccnc2c1)OCc3nnc4n3nc(cc4)c5ccccc5
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyridazines and derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3CD8 | Download | Experimental | e3cd8A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |