PDB ligand accession: QYT
DrugBank: DB04769
PubChem:
ChEMBL:
InChI Key: SQWZFLMPDUSYGV-POHAHGRESA-N
SMILES: c1cc2c(cc1C=C3C(=O)NC(=O)S3)nccn2
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2A5U | Download | Experimental | e2a5uA4 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |