PDB ligand accession: 1UO
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: IXXBWYJJOYSCNJ-JOCQHMNTSA-N
SMILES: c1cc(c2c(c1)nns2)c3c(c4c(cnc(c4o3)N)c5cnn(c5)C6CCC(CC6)O)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyrazolylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4L53 | Download | Experimental | e4l53A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |