Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 2/20 | 0.59 |
| ▸ | IKBKB | O14920 | 10/20 | 0.43 |
| ▸ | CHUK | O15111 | 10/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | CIT | O14578 | 5/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.37 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.37 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | AURKAIP1 | Q9NWT8 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2996351 | 0.88 | MAP3K5 (0.62) | MAP3K5IKBKBCHUKROCK1CIT | |
| Trifluoroacetic Acid SCHEMBL2982128 | 0.88 | MAP3K5 (0.62) | MAP3K5IKBKBCHUKROCK1CIT | |
| Trifluoroacetic Acid SCHEMBL2986293 | 0.85 | MAP3K5 (0.64) | MAP3K5IKBKBCHUKROCK1CIT | |
| Trifluoroacetic Acid SCHEMBL2984110 | 0.82 | MAP3K5 (0.58) | MAP3K5IKBKBCHUKROCK1CIT | |
| Trifluoroacetic Acid SCHEMBL2989883 | 0.82 | MAP3K5 (0.64) | MAP3K5IKBKBCHUKROCK1CIT | |
| SCHEMBL2982131 | 0.82 | MAP3K5 (0.61) | MAP3K5IKBKBCHUKROCK1CIT | |
| SCHEMBL2996355 | 0.82 | MAP3K5 (0.61) | MAP3K5IKBKBCHUKROCK1CIT | |
| Trifluoroacetic Acid SCHEMBL2991653 | 0.81 | MAP3K5 (0.58) | MAP3K5IKBKBCHUKROCK1CIT | |
| SCHEMBL2977496 | 0.81 | MAP3K5 (0.71) | MAP3K5IKBKBCHUKROCK1CIT | |
| SCHEMBL2991038 | 0.81 | MAP3K5 (0.71) | MAP3K5IKBKBCHUKROCK1CIT |
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-2162455-A2 | PYRROLOPYRIDINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS | Glaxo Group Limited (GB) | 2010-03-17 | — | — | EP | disclosed |
| WO-2008145688-A2 | PYRROLOPYRIDINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS | GLAXO GROUP LIMITED (GB) | 2008-12-04 | — | — | WO | disclosed |