Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RARB | P10826 | 2/20 | 0.37 |
| ▸ | RARG | P13631 | 2/20 | 0.37 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | RARA | P10276 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.35 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL9205463 | 0.90 | TRPA1 (0.40) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL9204877 | 0.90 | TRPA1 (0.38) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL9200445 | 0.89 | TRPA1 (0.39) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL9202931 | 0.88 | RARB (0.41) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL9205530 | 0.86 | TRPA1 (0.37) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL1636049 | 0.85 | TRPA1 (0.46) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL16606707 | 0.82 | TRPA1 (0.44) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL9953603 | 0.82 | TRPA1 (0.44) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL10044179 | 0.82 | TRPA1 (0.44) | TRPA1ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL18084307 | 0.77 | TRPA1 (0.41) | TRPA1ALDH1A1GAAMAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0525579-B1 | Process for preparing substituted hexemic acids | GIVAUDAN ROURE INT (CH) | 1995-09-20 | — | — | EP | claimed |
| US-5292902-A | Process for the manufacture of odorants and intermediates used therein | GIVAUDAN-ROURE CORPORATION (US) | 1994-03-08 | — | — | US | claimed |
| EP-0525579-A2 | Process for preparing substituted hexemic acids | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1993-02-03 | — | — | EP | claimed |
| EP-0525579-B1 | Process for preparing substituted hexemic acids | GIVAUDAN ROURE INT (CH) | 1995-09-20 | — | — | EP | disclosed |
| US-5292902-A | Process for the manufacture of odorants and intermediates used therein | GIVAUDAN-ROURE CORPORATION (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0525579-A2 | Process for preparing substituted hexemic acids | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1993-02-03 | — | — | EP | disclosed |