PDB ligand accession: JRE
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QDAISIXQQMBVSS-VIFPVBQESA-N
SMILES: CC(c1c(cncc1Cl)c2cc3c(nc2)N(CCC3)C(=O)N)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Bipyridines and oligopyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6Y0A | Download | Experimental | e6y0aA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
6R3S | Download | Experimental | e6r3sA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |