LoVo
Target ID: CHEMBL614721
Organism: Homo sapiens
Type: CELL-LINE
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| GEFITINIB | COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1 | IC50: 515.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [5*]N1CCOCC1 | 6.29 | 39 |  |
| [16*]c1ccc(F)c(Cl)c1 | 6.29 | 39 |  |
| [5*]N[5*] | 6.29 | 39 |  |
| [14*]c1ncnc2cc([16*])c([16*])cc12 | 6.29 | 39 |  |
| c1ccc(Nc2ncnc3ccc(OCCCN4CCOCC4)cc23)cc1 | 6.29 | 39 |  |