PDB ligand accession: 9TO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ANTWQGSNXAZMBT-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)Nc2nccc(n2)c3c[nH]nc3c4cccnc4
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 |
---|---|---|---|---|---|
6ACR | Download | Experimental | e6acrA1 e6acrB1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |