HEL 299
Target ID: CHEMBL614819
Organism: Homo sapiens
Type: CELL-LINE
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| GS-441524 | N#C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](CO)[C@@H](O)[C@H]1O | EC50: 4100.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [8*]CO | 5.39 | 36 |  |
| c1ncc2ccc(C3CCCO3)n2n1 | 5.39 | 36 |  |
| [13*][C@H]1O[C@]([13*])(C#N)[C@H](O)[C@@H]1O | 5.39 | 36 |  |
| [14*]c1ccc2c(N)ncnn12 | 5.39 | 36 |  |