Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16296191 | 0.72 | ALDH1A1 (0.47) | L3MBTL1ALDH1A1 | |
| SCHEMBL16296173 | 0.69 | DAO (0.33) | CA12CA1CA2CA4CA7 | |
| SCHEMBL29485045 | 0.64 | MGLL (0.59) | GLAL3MBTL1PARK7ALDH1A1 | |
| SCHEMBL31662966 | 0.63 | CA12 (0.47) | GLACA12CA1CA2CA4 | |
| SCHEMBL25291324 | 0.62 | AR (0.48) | GLAL3MBTL1OPRM1AKR1B1PTGS1 | |
| SCHEMBL8536677 | 0.62 | L3MBTL1 (0.37) | GLAL3MBTL1CA12CA1CA2 | |
| SCHEMBL8541895 | 0.62 | AR (0.48) | CA12CA1CA2CA4CA6 | |
| SCHEMBL8723259 | 0.62 | TDP1 (0.42) | GLAL3MBTL1CA12CA1CA2 | |
| SCHEMBL10362487 | 0.62 | ESR1 (0.45) | GLAL3MBTL1CA12CA1CA2 | |
| SCHEMBL9779945 | 0.61 | L3MBTL1 (0.36) | GLAL3MBTL1CA12CA1CA2 |
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-3008055-A1 | NOVEL TETRAZOLONE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2016-04-20 | — | — | EP | disclosed |
| WO-2014198592-A1 | NOVEL TETRAZOLONE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2014-12-18 | — | — | WO | disclosed |