HCC1143
Target ID: CHEMBL1075453
Organism: Homo sapiens
Type: CELL-LINE
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| PAZOPANIB | Cc1ccc(Nc2nccc(N(C)c3ccc4c(C)n(C)nc4c3)n2)cc1S(N)(=O)=O | IC50: 10.0 nM |  |
| MIDOSTAURIN | CO[C@@H]1[C@H](N(C)C(=O)c2ccccc2)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 | Kd: 11.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [5*]N([5*])C | 7.98 | 78 |  |
| [16*]c1ccc(C)c(S(N)(=O)=O)c1 | 8.0 | 39 |  |
| [5*]N[5*] | 8.0 | 39 |  |
| [14*]c1ccnc([14*])n1 | 8.0 | 39 |  |
| [16*]c1ccc2c(C)n(C)nc2c1 | 8.0 | 39 |  |