PDB ligand accession: 49J
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: AAUCXXCMBFZYRT-UHFFFAOYSA-N
SMILES: COc1cc(ccc1N)c2cc3c(c(sn3)N4CCOCC4)nc2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4Y8D | Download | Experimental | e4y8dA1 e4y8dB1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |