Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADK | P55263 | 5/20 | 0.43 |
| ▸ | AURKA | O14965 | 13/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 11/20 | 0.40 |
| ▸ | CDK8 | P49336 | 2/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
| ▸ | ACOX3 | O15254 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | ROS1 | P08922 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | FRK | P42685 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13429733 | 0.92 | ADK (0.48) | ADKAURKAAURKB | |
| SCHEMBL13430258 | 0.91 | ADK (0.43) | ADKAURKAAURKBRPS6KB1 | |
| SCHEMBL13429734 | 0.82 | AURKA (0.53) | ADKAURKAAURKBNTRK3NTRK2 | |
| SCHEMBL13399980 | 0.79 | AURKA (0.63) | ADKAURKAAURKBCDK8PLK4 | |
| SCHEMBL13625779 | 0.79 | AURKA (0.65) | AURKAAURKB | |
| SCHEMBL13689923 | 0.78 | AURKA (0.61) | AURKAAURKBCDK8PLK4ACOX3 | |
| SCHEMBL13625873 | 0.76 | AURKA (0.65) | AURKAAURKB | |
| SCHEMBL13430270 | 0.76 | KDR (0.40) | AURKAAURKBRPS6KB1KDR | |
| SCHEMBL13430289 | 0.75 | EGFR (0.56) | AURKAPDGFRBKITKDR | |
| SCHEMBL13625527 | 0.74 | AURKA (0.45) | AURKAAURKB |
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 |
|---|---|---|---|---|---|---|---|
| US-8765953-B2 | Compounds and methods for the treatment of pain and other diseases | AQUILUS PHARMACEUTICALS, INC. (US) | 2014-07-01 | — | — | US | disclosed |
| WO-2010036629-A2 | FUSED MULTICYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS | NATIONAL HEALTH RESEARCH INSTITUTES (TW) | 2010-04-01 | — | — | WO | disclosed |