PDB ligand accession: MES
DrugBank: DB03814
PubChem: 78165;4478249;
ChEMBL:
InChI Key: SXGZJKUKBWWHRA-UHFFFAOYSA-N
SMILES: C1COCC[NH+]1CCS(=O)(=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Oxazinanes
- Subclass: Morpholines
- Class: Oxazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6I81 | Download | Experimental | e6i81A1 | Bromodomain-like | LigPlot |
6FFG | Download | Experimental | e6ffgA1 | Bromodomain-like | LigPlot |
1X0J | Download | Experimental | e1x0jC1 | Bromodomain-like | LigPlot |
3AQA | Download | Experimental | e3aqaA1 | Bromodomain-like | LigPlot |
8PX2 | Download | Experimental | e8px2A1 | Bromodomain-like | LigPlot |
8B5G | Download | Experimental | e8b5gAAA1 | Bromodomain-like | LigPlot |
6ZB0 | Download | Experimental | e6zb0AAA1 | Bromodomain-like | LigPlot |
6K05 | Download | Experimental | e6k05B1 | Bromodomain-like | LigPlot |
8PX8 | Download | Experimental | e8px8A1 | Bromodomain-like | LigPlot |
6FFF | Download | Experimental | e6fffA1 | Bromodomain-like | LigPlot |