Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.60 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | NPY1R | P25929 | 1/20 | 0.56 |
| ▸ | NPY2R | P49146 | 1/20 | 0.56 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.55 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | XDH | P47989 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | APP | P05067 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29269302 | 1.00 | TRPA1 (0.60) | TRPA1MTNR1AHPGDNPY1RNPY2R | |
| SCHEMBL29269448 | 0.90 | TRPA1 (0.60) | TRPA1MTNR1AHPGDPDCD1CD274 | |
| SCHEMBL30996902 | 0.90 | TRPA1 (0.60) | TRPA1MTNR1AHPGDPDCD1CD274 | |
| SCHEMBL29269319 | 0.88 | TRPA1 (0.58) | TRPA1MTNR1AHPGDPDCD1CD274 | |
| SCHEMBL30996899 | 0.88 | TRPA1 (0.58) | TRPA1MTNR1AHPGDPDCD1CD274 | |
| SCHEMBL30996903 | 0.88 | ALDH1A1 (0.64) | TRPA1MTNR1AHPGDPDCD1CD274 | |
| SCHEMBL29269311 | 0.88 | ALDH1A1 (0.64) | TRPA1MTNR1AHPGDPDCD1CD274 | |
| SCHEMBL5702556 | 0.88 | APP (0.65) | TRPA1MTNR1AHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL5702554 | 0.88 | APP (0.65) | TRPA1MTNR1AHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL12517074 | 0.86 | ALDH1A1 (0.66) | HPGDNPY1RNPY2RPDCD1CD274 |
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-118307456-A | Coniferyl aldehyde derivative containing dithioacetal unit, and preparation method and application thereof | 贵州大学 | 2024-07-09 | — | — | CN | disclosed |