Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | TRPA1 | O75762 | 7/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Phenyl Ethanol SCHEMBL27632994 | 1.00 | TSHR (0.61) | TSHRTRPA1KDM4EALDH1A1LMNA | |
| Phenyl Ethanol SCHEMBL1872824 | 1.00 | TSHR (0.61) | TSHRTRPA1KDM4EALDH1A1LMNA | |
| Phenyl Ethanol SCHEMBL28081348 | 0.96 | TSHR (0.56) | TSHRTRPA1KDM4EALDH1A1LMNA | |
| Phenylpropanol SCHEMBL1906691 | 0.89 | LMNA (0.66) | TSHRTRPA1KDM4EALDH1A1LMNA | |
| Benzyl Alcohol SCHEMBL4915528 | 0.86 | TSHR (0.74) | TSHRTRPA1KDM4EALDH1A1LTA4H | |
| Phenyl Ethanol SCHEMBL7170311 | 0.84 | LMNA (0.56) | TSHRTRPA1KDM4EALDH1A1LMNA | |
| SCHEMBL18118664 | 0.84 | NOS3 (0.42) | TSHRALDH1A1LMNALTA4H | |
| SCHEMBL40702 | 0.84 | NOS3 (0.42) | TSHRALDH1A1LMNALTA4H | |
| Phenyl Ethanol SCHEMBL2164 | 0.83 | — | — | |
| Phenyl Ethanol SCHEMBL2165 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-100360490-C | Method for preparing aldehyde ketone by using oxyful to catalyze and oxidize alcohol | LANZHOU INST OF CHEMISTRY & PH (CN) | 2008-01-09 | — | — | CN | disclosed |
| CN-1796347-A | Method for preparing aldehyde ketone by using oxyful to catalyze and oxidize alcohol | LANZHOU INST OF CHEMISTRY & PH (CN) | 2006-07-05 | — | — | CN | disclosed |