PDB ligand accession: 3UO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NZMAVPMPPORZNT-UHFFFAOYSA-N
SMILES: COc1ccncc1NC(=O)c2ccnc(c2)NC(=O)C3CC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridinecarboxylic acids and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5F94 | Download | Experimental | e5f94A1 e5f94B1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |