PDB ligand accession: 8TN
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: OQIHNLNLZCEEGI-HNNXBMFYSA-N
SMILES: CC1=CSC2=CC(=C(C(=O)N12)c3cccc(c3)CN(C)C)C(C)Nc4c(c(ncn4)N)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5NCZ | Download | Experimental | e5nczA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |