NCI-H929
Target ID: CHEMBL4296391
Organism: Homo sapiens
Type: CELL-LINE
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| VORINOSTAT | O=C(CCCCCCC(=O)Nc1ccccc1)NO | Inhibition: 100.0 % |  |
| SELICICLIB | CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 | IC50: 450.0 nM |  |
| BORTEZOMIB | CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O | Ki: 0.62 nM |  |
| CORDYCEPIN | Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)C[C@H]1O | IC50: 0.5 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [16*]c1ccccc1 | 7.78 | 117 |  |
| [5*]N[5*] | 7.78 | 117 |  |
| [1*]C(=O)CCCCCCC(=O)NO | None | 39 |  |
| c1ccccc1 | None | 39 |  |
| [4*]C[8*] | 6.35 | 39 |  |