PDB ligand accession: 6BJ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: UKGSBPKSNSXMDN-UHFFFAOYSA-N
SMILES: c1ccnc(c1)CNC(=O)c2ccc(cc2)n3cc(cn3)c4ccncc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5IH8 | Download | Experimental | e5ih8A2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |