Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11059751 | 0.81 | ALDH1A1 (0.55) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL28762 | 0.78 | — | — | |
| Ethylene Glycol SCHEMBL5930511 | 0.74 | ALDH1A1 (0.55) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL11837362 | 0.74 | ALDH1A1 (0.44) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL13082386 | 0.73 | LMNA (0.50) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL1053655 | 0.73 | ALDH1A1 (0.48) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL20191265 | 0.72 | ALDH1A1 (0.43) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL14198222 | 0.72 | ALDH1A1 (0.43) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL7974373 | 0.71 | ALDH1A1 (0.39) | ALDH1A1ALOX15TRPA1 | |
| SCHEMBL7049979 | 0.70 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111533640-B | Compound, synthesis method thereof and mosquito-repellent spray | 清远市立道精细化工有限公司 | 2021-08-06 | — | — | CN | claimed |
| CN-111533640-A | Compound, synthesis method thereof and mosquito-repellent spray | 清远市立道精细化工有限公司 | 2020-08-14 | — | — | CN | claimed |
| CN-111533640-B | Compound, synthesis method thereof and mosquito-repellent spray | 清远市立道精细化工有限公司 | 2021-08-06 | — | — | CN | disclosed |
| CN-111533640-B | Compound, synthesis method thereof and mosquito-repellent spray | 清远市立道精细化工有限公司 | 2021-08-06 | — | — | CN | disclosed |
| CN-111533640-A | Compound, synthesis method thereof and mosquito-repellent spray | 清远市立道精细化工有限公司 | 2020-08-14 | — | — | CN | disclosed |
| CN-111533640-A | Compound, synthesis method thereof and mosquito-repellent spray | 清远市立道精细化工有限公司 | 2020-08-14 | — | — | CN | disclosed |