DMS-114
Target ID: CHEMBL614642
Organism: Homo sapiens
Type: CELL-LINE
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| GENTIAN VIOLET | CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc(N(C)C)cc2)cc1.[Cl-] | Lysis: 100.0 % |  |
| VORINOSTAT | O=C(CCCCCCC(=O)Nc1ccccc1)NO | Inhibition: 100.0 % |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [16*]c1ccccc1 | None | 39 |  |
| [1*]C(=O)CCCCCCC(=O)NO | None | 39 |  |
| [5*]N[5*] | None | 39 |  |
| c1ccccc1 | None | 39 |  |
| [7*]C([8*])[8*] | None | 22 |  |