PDB ligand accession: 4EJ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: OXQTXNVWTNDAQF-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CNc2ccc3ncc(n3n2)c4ccc(cc4)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YMJ | Download | Experimental | e4ymjA1 e4ymjB1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |