Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL11241178 | 1.00 | TRPA1 (0.37) | TRPA1MAPTALOX15 | |
| SCHEMBL29934708 | 1.00 | TRPA1 (0.37) | TRPA1MAPTALOX15 | |
| SCHEMBL10067412 | 0.76 | TRPA1 (0.38) | TRPA1MAPTALOX15 | |
| SCHEMBL11336191 | 0.75 | MAPT (0.41) | TRPA1MAPTALOX15 | |
| SCHEMBL10457502 | 0.74 | TRPA1 (0.40) | TRPA1MAPTALOX15 | |
| SCHEMBL11152583 | 0.71 | TRPA1 (0.43) | TRPA1MAPTALOX15 | |
| SCHEMBL9483270 | 0.71 | ALDH1A1 (0.43) | TRPA1MAPTALOX15 | |
| SCHEMBL5508599 | 0.71 | ALDH1A1 (0.43) | TRPA1MAPTALOX15 | |
| SCHEMBL20608602 | 0.71 | TRPA1 (0.41) | TRPA1MAPTALOX15 | |
| SCHEMBL11246743 | 0.70 | TRPA1 (0.40) | TRPA1MAPTALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4363331-A | FLAVORS; ODORS; FOOD, COSMETICS, AND DETERGENTS | GIVAUDAN CORPORATION (US) | 1982-12-14 | — | — | US | claimed |
| US-4352943-A | 3-Butadienyl-2,4,4-trimethylcyclohex-2-enone and derivatives thereof | GIVAUDAN CORPORATION (US) | 1982-10-05 | — | — | US | claimed |
| US-4313856-A | Perfume compositions containing oxygenated ionone derivatives | GIVAUDAN CORPORATION (US) | 1982-02-02 | — | — | US | claimed |