PDB ligand accession: X46
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LXKAYWZVBXYTGU-UHFFFAOYSA-N
SMILES: COc1cccc(c1)C(=O)c2c(nc(s2)Nc3ccccc3)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3QTS | Download | Experimental | e3qtsA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |