Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.48 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.34 |
| ▸ | CHIT1 | Q13231 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CHI3L1 | P36222 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL8945240 | 1.00 | TRPA1 (0.48) | TRPA1CCR5LMNAALDH1A1SLC6A3 | |
| Methyl Alcohol SCHEMBL8945244 | 1.00 | TRPA1 (0.48) | TRPA1CCR5LMNAALDH1A1SLC6A3 | |
| SCHEMBL30879620 | 0.79 | TRPA1 (0.41) | TRPA1CCR5LMNAALDH1A1LTB4R | |
| SCHEMBL28797063 | 0.78 | TRPA1 (0.40) | TRPA1CCR5LMNAALDH1A1PPARG | |
| SCHEMBL31429136 | 0.72 | PTGS1 (0.44) | TRPA1LMNAALDH1A1PPARGLTB4R | |
| SCHEMBL17993988 | 0.70 | TRPA1 (0.36) | TRPA1CCR5LMNAALDH1A1PPARG | |
| SCHEMBL5131364 | 0.69 | PTGS1 (0.53) | TRPA1LMNAEPHX1 | |
| SCHEMBL24625919 | 0.69 | TRPA1 (0.40) | TRPA1ALDH1A1LTB4RLTB4R2TSHR | |
| SCHEMBL14981032 | 0.68 | TRPA1 (0.45) | TRPA1CCR5LMNAALDH1A1SLC6A3 | |
| SCHEMBL29693296 | 0.67 | ALDH1A1 (0.43) | TRPA1CCR5ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5494821-A | ESTERIFICATION; OPTICAL RESOLUTION; SULFOESTERIFICATION; AZOLATION | KUREHA KAGAKU KOGYO K.K. (JP) | 1996-02-27 | — | — | US | disclosed |
| EP-0576834-A2 | Process for producing optically active 1,2-diol derivatives | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1994-01-05 | — | — | EP | disclosed |