Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | CFTR | P13569 | 2/20 | 0.36 |
| ▸ | CCNC | P24863 | 2/20 | 0.36 |
| ▸ | CDK8 | P49336 | 2/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PTPN6 | P29350 | 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 | |
|---|---|---|---|---|
| SCHEMBL31150452 | 1.00 | GABRA1 (0.38) | GABRA1GRM5CFTRCCNCCDK8 | |
| SCHEMBL29311708 | 0.76 | GLS (0.40) | GRIN2BGSK3BDYRK1A | |
| SCHEMBL7240100 | 0.76 | CYP17A1 (0.38) | SCN9AGRIN2BBCL2GSK3BDYRK1A | |
| SCHEMBL26839479 | 0.76 | GSK3B (0.39) | SCN9ABCL2GSK3BDYRK1AATR | |
| SCHEMBL30565562 | 0.76 | CYP17A1 (0.38) | SCN9AGRIN2BBCL2GSK3BDYRK1A | |
| SCHEMBL25317444 | 0.73 | GABRA1 (0.44) | GABRA1CCNCCDK8SCN9ACDK19 | |
| SCHEMBL30986515 | 0.71 | CYP17A1 (0.36) | SCN9AGRIN2BGSK3BDYRK1AATR | |
| SCHEMBL8162669 | 0.70 | CYP1A2 (0.42) | ATR | |
| SCHEMBL29442854 | 0.70 | LMNA (0.53) | GSK3BDYRK1AATR | |
| SCHEMBL15202941 | 0.70 | LMNA (0.53) | GSK3BDYRK1AATR |
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-4466258-A1 | NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2024-11-27 | — | — | EP | disclosed |
| WO-2023139085-A1 | NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2023-07-27 | — | — | WO | disclosed |