Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.57 |
| ▸ | PGR | P06401 | 1/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.54 |
| ▸ | DPP4 | P27487 | 1/20 | 0.53 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.53 |
| ▸ | F2 | P00734 | 1/20 | 0.50 |
| ▸ | ELANE | P08246 | 1/20 | 0.50 |
| ▸ | CTSG | P08311 | 1/20 | 0.50 |
| ▸ | CMA1 | P23946 | 1/20 | 0.50 |
| ▸ | CTRC | Q99895 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11836683 | 0.92 | KMT2A (0.59) | ALDH1A1KMT2AMEN1GAATLR9 | |
| SCHEMBL6926171 | 0.86 | NR1H3 (0.53) | ALDH1A1KMT2AMEN1GAATLR9 | |
| SCHEMBL30472945 | 0.86 | ALDH1A1 (0.72) | ALDH1A1KMT2AMEN1GAATLR9 | |
| SCHEMBL325212 | 0.86 | ALDH1A1 (0.72) | ALDH1A1KMT2AMEN1GAATLR9 | |
| SCHEMBL11105064 | 0.84 | PGR (0.53) | KMT2AMEN1GAAPGRDPP4 | |
| SCHEMBL28673973 | 0.84 | KMT2A (0.50) | KMT2AMEN1GAADPP4NR1H2 | |
| SCHEMBL11844877 | 0.82 | NR1H3 (0.53) | KMT2AMEN1DPP4NR1H2NR1H3 | |
| SCHEMBL11842657 | 0.80 | NR1H3 (0.48) | ALDH1A1KMT2AMEN1GAATLR9 | |
| SCHEMBL28812426 | 0.78 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1GAATLR9 | |
| SCHEMBL29842449 | 0.78 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1GAATLR9 |
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-116253670-A | Method for introducing alkynyl disulfide bond at mercapto end | 山西蓬勃健康科技有限公司 | 2023-06-13 | — | — | CN | disclosed |