PDB ligand accession: T9N
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NYRVLHGVDPPWJS-UHFFFAOYSA-N
SMILES: Cc1c(sc(n1)NC)c2c(cnc(n2)Nc3cccc(c3)O)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Thiazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4BCJ | Download | Experimental | e4bcjA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |