Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29095954 | 0.78 | CES2 (0.41) | CES2CES1ALDH1A1BCAT1BCHE | |
| SCHEMBL27263318 | 0.76 | CES2 (0.47) | CES2CES1ALDH1A1BCAT1BCHE | |
| SCHEMBL16951668 | 0.76 | CES2 (0.40) | CES2CES1ALDH1A1BCAT1BCHE | |
| SCHEMBL953145 | 0.76 | CES2 (0.40) | CES2CES1ALDH1A1BCAT1BCHE | |
| SCHEMBL953306 | 0.72 | CES2 (0.37) | CES2CES1ALDH1A1BCAT1GAA | |
| SCHEMBL10859313 | 0.72 | CES2 (0.37) | CES2CES1ALDH1A1BCAT1 | |
| SCHEMBL10079576 | 0.69 | CES2 (0.41) | CES2CES1ALDH1A1BCHE | |
| SCHEMBL16956757 | 0.69 | CES2 (0.47) | CES2CES1BCHE | |
| SCHEMBL19716587 | 0.68 | CES2 (0.34) | CES2CES1ALDH1A1BCAT1 | |
| SCHEMBL28045728 | 0.68 | CES2 (0.52) | CES2CES1ALDH1A1BCHEGAA |
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-1366026-B1 | PYRIMIDINE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL CO (JP) | 2004-12-01 | — | — | EP | disclosed |