Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.70 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.61 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.61 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.61 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.61 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.56 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30934 | 0.97 | TRPA1 (0.77) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| Water SCHEMBL3896311 | 0.94 | TRPA1 (0.74) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL9735526 | 0.92 | TRPA1 (0.71) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| Naphthalene SCHEMBL17141391 | 0.90 | TRPA1 (0.68) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL1406203 | 0.87 | TRPA1 (0.67) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| Alcohol SCHEMBL6562414 | 0.87 | TRPA1 (0.79) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL1678303 | 0.85 | TRPA1 (0.63) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL15101101 | 0.85 | TRPA1 (1.00) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL14222474 | 0.85 | TRPA1 (0.63) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL19725385 | 0.84 | TRPA1 (0.69) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10660831-B2 | Cosmetic or pharmaceutical composition, to be applied topically | KUHS GMBH (DE) | 2020-05-26 | — | — | US | disclosed |
| CN-108601803-A | Composition is for reducing the purposes of the cholesterol levels of mammal, preparation method, composition and the method for being used to prepare the food additives comprising the composition | 格莱努拉有限公司 | 2018-09-28 | — | — | CN | disclosed |
| US-20150374595-A1 | COSMETIC OR PHARMACEUTICAL COMPOSITION, TO BE APPLIED TOPICALLY | LG HOUSEHOLD & HEALTH CARE LTD. (KR) | 2015-12-31 | — | — | US | disclosed |
| US-20130028947-A1 | PHARMACEUTICAL COMPOSITION FOR TOPICAL APPLICATION | KUHS GMBH (DE) | 2013-01-31 | — | — | US | disclosed |
| US-20110027327-A1 | COSMETIC OR PHARMACEUTICAL COMPOSITION FOR TOPICAL APPLICATION | KUHS GMBH (DE) | 2011-02-03 | — | — | US | disclosed |