Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.31 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL28679416 | 0.86 | ALDH1A1 (0.49) | ALDH1A1HTTSMN1; SMN2PDK1PDK2 | |
| SCHEMBL22897879 | 0.85 | CYP1A2 (0.35) | ALDH1A1HTTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL22897939 | 0.81 | GUCY1A1 (0.32) | ALDH1A1 | |
| SCHEMBL22897941 | 0.79 | ALDH1A1 (0.34) | ALDH1A1HTTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL22897830 | 0.78 | ALDH1A1 (0.36) | ALDH1A1HTTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL22897508 | 0.73 | ALDH1A1 (0.51) | ALDH1A1HTTSMN1; SMN2PDK1PDK2 | |
| SCHEMBL29559840 | 0.73 | ALDH1A1 (0.51) | ALDH1A1HTTSMN1; SMN2PDK1PDK2 | |
| SCHEMBL22897913 | 0.72 | ALDH1A1 (0.52) | ALDH1A1HTTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL22897756 | 0.71 | SLC6A4 (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL29559393 | 0.71 | SLC6A4 (0.41) | ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021011722-A1 | MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2021-01-21 | — | — | WO | disclosed |