PDB ligand accession: AWJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MXETZPYUZKZIMB-MCMMXHMISA-N
SMILES: Cc1c(sc(n1)C(C)(CO)O)c2cc(c(nc2)N)OC(C)c3cc(ccc3N4NC=CN4)F
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 |
---|---|---|---|---|---|
7R7R | Download | Experimental | e7r7rA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
4CD0 | Download | Experimental | e4cd0A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |