PDB ligand accession: 4RM
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: NNYRUSJDMFVRJF-JHRGVAJVSA-N
SMILES: CCc1ccc(cc1)N=C2N(C(=O)C(=Cc3ccncc3)S2)CCOC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: None
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4ZTQ | Download | Experimental | e4ztqA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |