Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL112994 | 0.84 | TDP1 (0.54) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL27498397 | 0.84 | TDP1 (0.54) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL26606263 | 0.84 | TDP1 (0.54) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL28008217 | 0.82 | TDP1 (0.52) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL7523892 | 0.82 | TRPA1 (0.52) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL105502 | 0.82 | TRPA1 (0.52) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL7527686 | 0.82 | TRPA1 (0.52) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL29066465 | 0.81 | TRPA1 (0.45) | TRPA1SIGMAR1SLC6A2SLC6A3MEN1 | |
| Fluoride SCHEMBL28017588 | 0.81 | TRPA1 (0.50) | TRPA1SIGMAR1SLC6A2TAAR1MAOA | |
| SCHEMBL109763 | 0.79 | TSHR (0.47) | SLC6A2SLC6A4SLC6A3MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115427421-A | 3' -ketoside compounds with slow release of volatile alcohols | 格莱克科学有限公司 | 2022-12-02 | — | — | CN | claimed |
| CN-115427421-A | 3' -ketoside compounds with slow release of volatile alcohols | 格莱克科学有限公司 | 2022-12-02 | — | — | CN | disclosed |