PDB ligand accession: 3IP
DrugBank: DB02352
PubChem:
ChEMBL:
InChI Key: NMCBWICNRJLKKM-UHFFFAOYSA-N
SMILES: c1ccc(cc1)COc2cccnc2N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Aminopyridines and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1W7H | Download | Experimental | e1w7hA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |