Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3963428 | 0.88 | ALDH1A1 (0.68) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| Hydrochloric Acid SCHEMBL28852620 | 0.86 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL27404873 | 0.85 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL7696360 | 0.85 | ALDH1A1 (0.59) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL8492777 | 0.84 | ALDH1A1 (0.63) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL18673 | 0.84 | ALDH1A1 (0.68) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL1518084 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL29152110 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL21121060 | 0.83 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| Ammonia Solution, Strong SCHEMBL27465058 | 0.83 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A |
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-117164418-B | Alpha-halogenated ketone, efficient synthesis method and application thereof | 徐州医科大学 | 2024-07-02 | — | — | CN | disclosed |
| CN-117164418-A | Alpha-halogenated ketone, efficient synthesis method and application thereof | 徐州医科大学 | 2023-12-05 | — | — | CN | disclosed |