PDB ligand accession: D36
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SZKRTTIHILIRKD-UHFFFAOYSA-N
SMILES: CS(=O)(=O)N(CCN)c1ccc(cn1)Nc2ncc3cnn(c3n2)C4CCCCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrazolopyrimidines
- Subclass: Pyrazolo[3,4-d]pyrimidines
- Class: Pyrazolopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3R21 | Download | Experimental | e3r21A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |