Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL331501 | 0.83 | TRPA1 (0.47) | TRPA1ALDH1A1TSHR | |
| SCHEMBL3526008 | 0.78 | TRPA1 (0.48) | TRPA1ALDH1A1TSHR | |
| SCHEMBL2702074 | 0.75 | TRPA1 (0.50) | TRPA1ALDH1A1TSHR | |
| SCHEMBL30536364 | 0.75 | IDO1 (0.39) | TSHR | |
| SCHEMBL19002957 | 0.73 | TRPA1 (0.40) | TRPA1ALDH1A1TSHR | |
| SCHEMBL2327331 | 0.73 | TRPA1 (0.31) | TRPA1ALDH1A1TSHR | |
| SCHEMBL642402 | 0.71 | IDO1 (0.40) | TRPA1ALDH1A1TSHR | |
| SCHEMBL17043177 | 0.69 | — | — | |
| SCHEMBL19908902 | 0.69 | TRPA1 (0.43) | TRPA1ALDH1A1TSHR | |
| SCHEMBL23654211 | 0.69 | LOXL2 (0.36) | TRPA1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3124490-A1 | HIGH STABILITY POLYIONIC LIQUID SALTS | Sigma-Aldrich Co. LLC (US) | 2017-02-01 | — | — | EP | disclosed |