PDB ligand accession: 4RJ
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: ZJQWORQRPDYKRS-KGQWDEOMSA-N
SMILES: CCc1ccc(cc1)N=C2N(C(=O)C(=Cc3ccnc(c3)Nc4ccc(cn4)C(=O)O)S2)C
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 |
---|---|---|---|---|---|
4ZTR | Download | Experimental | e4ztrA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |