Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL28694139 | 0.85 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2HTTMAPTCYP2C19 | |
| SCHEMBL22897937 | 0.78 | ALDH1A1 (0.32) | ALDH1A1SMN1; SMN2HTTCYP2C19CYP1A2 | |
| SCHEMBL22897508 | 0.75 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2HTTMAPTCYP2C19 | |
| SCHEMBL29559840 | 0.75 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2HTTMAPTCYP2C19 | |
| SCHEMBL22897879 | 0.72 | CYP1A2 (0.35) | ALDH1A1SMN1; SMN2HTTMAPTCYP2C19 | |
| SCHEMBL22897941 | 0.71 | ALDH1A1 (0.34) | ALDH1A1SMN1; SMN2HTTCYP2C19CYP1A2 | |
| SCHEMBL22897883 | 0.69 | SMN1; SMN2 (0.40) | ALDH1A1SMN1; SMN2HTTMAPTMEN1 | |
| SCHEMBL22897907 | 0.69 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HTTMAPTCYP2C19 | |
| SCHEMBL22897451 | 0.69 | ALDH1A1 (0.37) | ALDH1A1HTTMAPTMEN1KMT2A | |
| SCHEMBL22897926 | 0.67 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2HTTMAPTCYP2C19 |
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 |