Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Ether SCHEMBL28860658 | 0.86 | CES1 (0.31) | CES1 | |
| Butoxyethanol SCHEMBL28535738 | 0.84 | TSHR (0.59) | ALDH1A1NR1H2NR1H3TSHRMAPK1 | |
| Tetraethylene Glycol SCHEMBL28079853 | 0.81 | MEN1 (0.38) | ALDH1A1NR1H2NR1H3TSHRMAPK1 | |
| 2-Methoxyethanol SCHEMBL28901932 | 0.80 | — | — | |
| Alcohol SCHEMBL28291903 | 0.79 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| 2-Ethoxyethanol SCHEMBL5570314 | 0.74 | ALDH1A1 (0.78) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| Butyl Alcohol SCHEMBL16616621 | 0.74 | ALDH1A1 (0.48) | ALDH1A1TSHRMEN1KMT2ACES1 | |
| 2-Ethoxyethanol SCHEMBL11024472 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL9547497 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK1MEN1KMT2A | |
| 2-Ethoxyethanol SCHEMBL9432157 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRMAPK1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-107163254-A | A kind of preparation method and applications of solvent-borne type hydro-oleophobicity fluorohydrocarbon base silicones | 陕西科技大学 | 2017-09-15 | — | — | CN | disclosed |