Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 9/20 | 0.46 |
| ▸ | CDK9 | P50750 | 9/20 | 0.46 |
| ▸ | ALK | Q9UM73 | 11/20 | 0.45 |
| ▸ | INSR | P06213 | 5/20 | 0.43 |
| ▸ | MET | P08581 | 4/20 | 0.43 |
| ▸ | ROS1 | P08922 | 4/20 | 0.43 |
| ▸ | EGFR | P00533 | 3/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.41 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1013608 | 0.84 | CDK7 (0.46) | CDK7CDK9ALKINSRMET | |
| SCHEMBL1014467 | 0.84 | ALK (0.48) | CDK7CDK9ALKINSRMET | |
| SCHEMBL3959009 | 0.82 | ALK (0.51) | CDK7CDK9ALKMETROS1 | |
| SCHEMBL12547364 | 0.78 | ALK (0.55) | CDK7CDK9ALKINSRMET | |
| SCHEMBL12568523 | 0.78 | ALK (0.47) | CDK7CDK9ALKINSRMET | |
| SCHEMBL1013606 | 0.78 | CDK7 (0.48) | CDK7CDK9ALKMETROS1 | |
| SCHEMBL1493586 | 0.77 | ALK (0.51) | CDK7CDK9ALKMETROS1 | |
| SCHEMBL1014586 | 0.77 | CDK7 (0.48) | CDK7CDK9ALKINSRMET | |
| SCHEMBL1014486 | 0.77 | ALK (0.47) | CDK7CDK9ALKINSRMET | |
| SCHEMBL1014768 | 0.76 | CDK7 (0.47) | CDK7CDK9ALKINSRMET |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2271630-A1 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2011-01-12 | — | — | EP | disclosed |
| WO-2009126515-A1 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2009-10-15 | — | — | WO | disclosed |