Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | EP300 | Q09472 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.39 |
| ▸ | GAPDH | P04406 | 1/20 | 0.39 |
| ▸ | FASN | P49327 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13825221 | 1.00 | TRPA1 (0.48) | TRPA1TSHRALDH1A1EP300PTPN1 | |
| SCHEMBL30698180 | 1.00 | TRPA1 (0.48) | TRPA1TSHRALDH1A1EP300PTPN1 | |
| SCHEMBL23087045 | 1.00 | TRPA1 (0.48) | TRPA1TSHRALDH1A1EP300PTPN1 | |
| SCHEMBL23087043 | 1.00 | TRPA1 (0.48) | TRPA1TSHRALDH1A1EP300PTPN1 | |
| SCHEMBL29068787 | 0.84 | TRPA1 (0.41) | TRPA1TSHRALDH1A1PTPN1MAPT | |
| SCHEMBL6577157 | 0.81 | EP300 (0.50) | TRPA1TSHRALDH1A1EP300PTPN1 | |
| SCHEMBL30924809 | 0.81 | TSHR (0.50) | TSHRALDH1A1EP300PTPN1MAPT | |
| SCHEMBL11514916 | 0.80 | EP300 (0.39) | TSHRALDH1A1EP300PTPN1MAPT | |
| SCHEMBL1785247 | 0.79 | TSHR (0.52) | TSHREP300PTPN1FAAHTRPV1 | |
| SCHEMBL1129285 | 0.79 | TSHR (0.52) | TSHREP300PTPN1FAAHTRPV1 |
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-112105597-A | Dienal compound and perfume composition | 高砂香料工业株式会社 | 2020-12-18 | — | — | CN | disclosed |