Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP7 | P09237 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.43 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5217555 | 0.77 | TAAR1 (0.48) | CYP2C19PTGES2ALDH1A1LMNATAAR1 | |
| SCHEMBL5217546 | 0.77 | TAAR1 (0.48) | CYP2C19PTGES2ALDH1A1LMNATAAR1 | |
| SCHEMBL5217923 | 0.77 | TAAR1 (0.48) | CYP2C19PTGES2ALDH1A1LMNATAAR1 | |
| SCHEMBL12711171 | 0.76 | TRPA1 (0.45) | PTGES2ALDH1A1LMNATAAR1TRPA1 | |
| SCHEMBL12711151 | 0.76 | TRPA1 (0.45) | PTGES2ALDH1A1LMNATAAR1TRPA1 | |
| SCHEMBL17018545 | 0.76 | PSIP1 (0.54) | HSD11B1PTGES2ALDH1A1SCN3ATAAR1 | |
| SCHEMBL6718127 | 0.75 | TAAR1 (0.50) | CYP2C19PTGES2ALDH1A1LMNATAAR1 | |
| SCHEMBL17086665 | 0.75 | TAAR1 (0.50) | PTGES2ALDH1A1LMNATAAR1TRPA1 | |
| SCHEMBL17086715 | 0.75 | TAAR1 (0.50) | PTGES2ALDH1A1LMNATAAR1TRPA1 | |
| SCHEMBL17258982 | 0.75 | PTGES2 (0.57) | PTGES2TAAR1TRPA1 |
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-104230770-B | The application of styryl sulfone compound, its preparation method as well as neuroprotective agent | 华夏生生药业(北京)有限公司 | 2017-11-21 | — | — | CN | disclosed |