Cyclooxygenase-2
Target ID: CHEMBL230
Organism: Homo sapiens
Type: SINGLE PROTEIN
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| VALDECOXIB | Cc1onc(-c2ccccc2)c1-c1ccc(S(N)(=O)=O)cc1 | Ki: 54000.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [16*]c1ccccc1 | 4.27 | 34 |  |
| [14*]c1noc(C)c1[16*] | 4.27 | 34 |  |
| c1ccc(-c2conc2-c2ccccc2)cc1 | 4.27 | 34 |  |
| [16*]c1ccc(S(N)(=O)=O)cc1 | 4.27 | 34 |  |