Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK5 | Q8IW41 | 6/20 | 0.44 |
| ▸ | TTK | P33981 | 7/20 | 0.39 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25014195 | 0.93 | MAPKAPK5 (0.42) | MAPKAPK5TTKPTK6AURKAFYN | |
| SCHEMBL22124850 | 0.87 | MAPKAPK5 (0.41) | MAPKAPK5TTKPTK6AURKB | |
| SCHEMBL22123261 | 0.87 | MAPKAPK5 (0.42) | MAPKAPK5TTKPTK6AURKAFYN | |
| SCHEMBL30183474 | 0.87 | MAPKAPK5 (0.42) | MAPKAPK5TTKPTK6AURKAFYN | |
| SCHEMBL22122945 | 0.86 | MAPKAPK5 (0.41) | MAPKAPK5TTKPTK6AURKAJAK2 | |
| SCHEMBL30403346 | 0.86 | MAPKAPK5 (0.41) | MAPKAPK5TTKPTK6AURKAJAK2 | |
| Hydrochloric Acid SCHEMBL22123929 | 0.85 | MAPKAPK5 (0.41) | MAPKAPK5TTKPTK6JAK2JAK1 | |
| SCHEMBL22160884 | 0.85 | MAPKAPK5 (0.43) | MAPKAPK5TTKPTK6AURKASRC | |
| SCHEMBL22123736 | 0.83 | MAPKAPK5 (0.39) | MAPKAPK5TTKPTK6AURKB | |
| SCHEMBL30193289 | 0.83 | MAPKAPK5 (0.39) | MAPKAPK5TTKPTK6AURKB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020126953-A1 | NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS | F. HOFFMANN-LA ROCHE AG (CH) | 2020-06-25 | — | — | WO | disclosed |