PDB ligand accession: B2D
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GZLYPLRRKZCYLV-UHFFFAOYSA-N
SMILES: COc1cc2c(c(ccn2)NCc3nnc4n3nc(cc4)c5ccccc5)nc1
Drug action: n/a
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 |
---|---|---|---|---|---|
3I5N | Download | Experimental | e3i5nA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |