PDB ligand accession: I74
DrugBank: DB16061
PubChem:
ChEMBL:
InChI Key: YCVGLKWJKIKVBI-MJGOQNOKSA-N
SMILES: CC(C)c1cnn2c1nc(cc2NCc3ccccc3)NCC4CCNCC4O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrazolopyrimidines
- Subclass: Pyrazolo[1,5-a]pyrimidines
- Class: Pyrazolopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5JQ5 | Download | Experimental | e5jq5A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |