Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL859684 | 0.84 | TSHR (0.44) | ALDH1A1L3MBTL1SMN1; SMN2 | |
| SCHEMBL9428201 | 0.82 | NPSR1 (0.42) | ALDH1A1LMNAL3MBTL1HTT | |
| SCHEMBL28567613 | 0.80 | ALDH1A1 (0.37) | ALDH1A1LMNAL3MBTL1HTTRAB9A | |
| SCHEMBL10981633 | 0.79 | NPSR1 (0.39) | ALDH1A1APOBEC3AAPOBEC3GNPC1RAB9A | |
| SCHEMBL4336590 | 0.78 | LMNA (0.44) | ALDH1A1LMNAL3MBTL1HTTRAB9A | |
| SCHEMBL10801789 | 0.78 | NPSR1 (0.41) | ALDH1A1LMNAHTTAPOBEC3AAPOBEC3G | |
| SCHEMBL9428901 | 0.78 | LMNA (0.57) | ALDH1A1LMNAL3MBTL1HTTNPC1 | |
| SCHEMBL18605355 | 0.77 | LMNA (0.43) | ALDH1A1LMNAL3MBTL1HTTRAB9A | |
| SCHEMBL4348580 | 0.76 | LMNA (0.42) | ALDH1A1LMNAL3MBTL1HTTRAB9A | |
| SCHEMBL18605168 | 0.75 | ALDH1A1 (0.42) | ALDH1A1LMNAL3MBTL1HTTNPC1 |
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-115894397-A | Synthesis method of 3-oxo-2-propionyl methyl valerate | 北京岳达生物科技有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-114716389-A | Synthetic method of 3, 5-diethylisoxazole-4-carboxylic acid | 北京岳达生物科技有限公司 | 2022-07-08 | — | — | CN | disclosed |