Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.33 |
| ▸ | LSS | P48449 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hexanethiol SCHEMBL27492299 | 1.00 | TSHR (0.38) | TSHRTHRBDNM1LSSALDH1A1 | |
| SCHEMBL11788878 | 0.98 | TSHR (0.33) | TSHRTHRB | |
| Tridecane SCHEMBL28187903 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Decane SCHEMBL27897264 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| SCHEMBL27659453 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Nonane SCHEMBL29091995 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Dodecane SCHEMBL6036923 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| SCHEMBL27852473 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Octane SCHEMBL22749440 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Octane SCHEMBL2389585 | 0.87 | TSHR (0.50) | TSHRTHRBDNM1ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-114106033-A | 3-alkyl propyl thioether-based triethoxysilane and preparation method and application thereof | 山东阳谷华泰化工股份有限公司 | 2022-03-01 | — | — | CN | disclosed |