PDB ligand accession: CK3
DrugBank: DB04101
PubChem: 447957;6400892;9547884;
ChEMBL:
InChI Key: OVKZTPFHUYGZBI-UHFFFAOYSA-N
SMILES: Cc1c(sc(n1)C)c2ccnc(n2)NC=NO
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 |
---|---|---|---|---|---|
1PXK | Download | Experimental | e1pxkA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |