Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK6 | Q13882 | 13/20 | 0.48 |
| ▸ | LCK | P06239 | 5/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.37 |
| ▸ | EGFR | P00533 | 5/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.35 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22123032 | 0.90 | PTK6 (0.48) | PTK6LCKAURKBEGFRERBB2 | |
| SCHEMBL22122928 | 0.90 | PTK6 (0.51) | PTK6LCKAURKBEGFRERBB2 | |
| SCHEMBL30171940 | 0.90 | PTK6 (0.51) | PTK6LCKAURKBEGFRERBB2 | |
| SCHEMBL30402648 | 0.90 | PTK6 (0.47) | PTK6LCKAURKBEGFRHTR2A | |
| SCHEMBL22123327 | 0.89 | PTK6 (0.47) | PTK6LCKAURKBEGFRERBB2 | |
| Formic Acid SCHEMBL22123801 | 0.87 | PTK6 (0.45) | PTK6LCKAURKBEGFRERBB2 | |
| Formic Acid SCHEMBL30402623 | 0.87 | PTK6 (0.45) | PTK6LCKAURKBEGFRERBB2 | |
| SCHEMBL30183416 | 0.86 | PTK6 (0.50) | PTK6LCKAURKBEGFRERBB2 | |
| SCHEMBL22123217 | 0.86 | PTK6 (0.48) | PTK6LCKAURKBEGFRERBB2 | |
| SCHEMBL22123977 | 0.83 | PTK6 (0.44) | PTK6AURKBEGFRERBB2HTR4 |
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-3898631-A1 | NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS | F. Hoffmann-La Roche AG (CH) | 2021-10-27 | — | — | EP | disclosed |
| WO-2020126953-A1 | NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS | F. HOFFMANN-LA ROCHE AG (CH) | 2020-06-25 | — | — | WO | disclosed |