PDB ligand accession: 3XL
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NMTUQTHXOJLRMZ-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)c2cc3c4cc(ncc4[nH]c3nc2)C#N)O
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 |
---|---|---|---|---|---|
4RVL | Download | Experimental | e4rvlA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |