PDB ligand accession: ETS
DrugBank: DB00869
PubChem:
ChEMBL:
InChI Key: IAVUPMFITXYVAF-XPUUQOCRSA-N
SMILES: CCNC1CC(S(=O)(=O)c2c1cc(s2)S(=O)(=O)N)C
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Thiophenes
- Subclass: 2,3,5-trisubstituted thiophenes
- Class: Thiophenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4M2U | Download | Experimental | e4m2uA1 | Carbonic anhydrase | LigPlot |
4M2W | Download | Experimental | e4m2wA1 | Carbonic anhydrase | LigPlot |
6BC9 | Download | Experimental | e6bc9A1 | Carbonic anhydrase | LigPlot |
4K13 | Download | Experimental | e4k13A1 | Carbonic anhydrase | LigPlot |
1CIL | Download | Experimental | e1cilA1 | Carbonic anhydrase | LigPlot |