Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.57 |
| ▸ | PPARG | P37231 | 1/20 | 0.57 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.54 |
| ▸ | MMP13 | P45452 | 2/20 | 0.54 |
| ▸ | MMP1 | P03956 | 2/20 | 0.54 |
| ▸ | MMP9 | P14780 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.47 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29169698 | 1.00 | NFE2L2 (0.57) | NFE2L2PPARGTRPA1MMP13MMP1 | |
| SCHEMBL28588433 | 0.94 | TRPA1 (0.54) | NFE2L2PPARGTRPA1MMP13MMP1 | |
| SCHEMBL28588431 | 0.94 | TRPA1 (0.54) | NFE2L2PPARGTRPA1MMP13MMP1 | |
| SCHEMBL6914365 | 0.84 | PSIP1 (0.48) | NFE2L2PPARGALDH1A1LMNAHTT | |
| SCHEMBL6914364 | 0.84 | PSIP1 (0.48) | NFE2L2PPARGALDH1A1LMNAHTT | |
| SCHEMBL29169692 | 0.83 | CTSK (0.58) | PPARGALDH1A1HSD11B1HTTMEN1 | |
| SCHEMBL9620558 | 0.83 | CTSK (0.58) | PPARGALDH1A1HSD11B1HTTMEN1 | |
| SCHEMBL29149687 | 0.79 | CHRM2 (0.56) | NFE2L2ALDH1A1LMNANPSR1 | |
| SCHEMBL29149688 | 0.79 | CHRM2 (0.56) | NFE2L2ALDH1A1LMNANPSR1 | |
| SCHEMBL29149689 | 0.78 | NFE2L2 (0.47) | NFE2L2PPARGTRPA1MMP13MMP1 |
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-117142916-A | Preparation method of allyl sulfone compound | 安徽金桐精细化学有限公司 | 2023-12-01 | — | — | CN | disclosed |
| CN-116969868-A | Synthesis method of allyl sulfonyl compound | 南通大学 | 2023-10-31 | — | — | CN | disclosed |