PDB ligand accession: 1UL
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XDCWLOMVUOZXFY-UHFFFAOYSA-N
SMILES: CC(=O)N1CCC(CC1)n2cc(cn2)c3cnc(c4c3cc(o4)c5cccc6c5snn6)N
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 |
---|---|---|---|---|---|
4L52 | Download | Experimental | e4l52A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |