Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19694297 | 0.81 | TSHR (0.32) | ALDH1A1 | |
| SCHEMBL4780044 | 0.79 | ALOX15 (0.33) | ALOX15 | |
| SCHEMBL1856831 | 0.78 | — | — | |
| SCHEMBL28985940 | 0.78 | — | — | |
| SCHEMBL4778857 | 0.77 | TSHR (0.44) | ALDH1A1ALOX15 | |
| SCHEMBL11729937 | 0.77 | — | — | |
| SCHEMBL19694153 | 0.75 | — | — | |
| SCHEMBL13455861 | 0.74 | ALDH1A1 (0.32) | ALDH1A1ALOX15 | |
| SCHEMBL18862933 | 0.74 | ALOX15 (0.52) | ALDH1A1ALOX15 | |
| SCHEMBL14303352 | 0.74 | ALDH1A1 (0.36) | ALDH1A1CA1CA2 |
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-109310602-A | Spices material | 高砂香料工业株式会社 | 2019-02-05 | — | — | CN | disclosed |
| WO-2008009841-A1 | NEW ODORIFEROUS COMPOUNDS, SYNTHESIS PROCESS AND USES THEREOF | V. MANE FILS (FR) | 2008-01-24 | — | — | WO | disclosed |