Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK6 | Q13882 | 13/20 | 0.41 |
| ▸ | TTK | P33981 | 3/20 | 0.36 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.36 |
| ▸ | LCK | P06239 | 5/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TAB1 | Q15750 | 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 | |
|---|---|---|---|---|
| SCHEMBL30171750 | 0.91 | PTK6 (0.43) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22123938 | 0.91 | PTK6 (0.43) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22125031 | 0.91 | PTK6 (0.39) | PTK6TTKMAPKAPK5AURKBLCK | |
| Formic Acid SCHEMBL25172093 | 0.89 | PTK6 (0.38) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22123937 | 0.89 | PTK6 (0.41) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22124075 | 0.88 | PTK6 (0.41) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL30172050 | 0.88 | PTK6 (0.41) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22123992 | 0.88 | PTK6 (0.41) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22139142 | 0.88 | PTK6 (0.40) | PTK6TTKMAPKAPK5AURKBLCK | |
| SCHEMBL22124271 | 0.88 | PTK6 (0.40) | PTK6TTKMAPKAPK5AURKBLCK |
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 |
|---|---|---|---|---|---|---|---|
| EP-3898631-B1 | NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS | HOFFMANN LA ROCHE (CH) | 2023-01-18 | — | — | EP | disclosed |