Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.34 |
| ▸ | P2RY14 | Q15391 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | APLNR | P35414 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.32 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 2/20 | 0.32 |
| ▸ | ACACA | Q13085 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23907150 | 1.00 | L3MBTL1 (0.41) | L3MBTL1PLA2G4ASCDMAPTHDAC3 | |
| SCHEMBL28427418 | 0.90 | HDAC3 (0.33) | SCDHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL28427420 | 0.90 | HDAC3 (0.33) | SCDHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL28433237 | 0.89 | SCD (0.34) | SCDMAPTHDAC3HDAC8NCOR2 | |
| SCHEMBL29441567 | 0.89 | ATR (0.35) | SCDHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL28426215 | 0.89 | ATR (0.35) | SCDHDAC3HDAC8NCOR2ACHE | |
| SCHEMBL22207026 | 0.88 | LMNA (0.35) | L3MBTL1SCDMAPTHDAC3HDAC8 | |
| SCHEMBL22207024 | 0.88 | LMNA (0.35) | L3MBTL1SCDMAPTHDAC3HDAC8 | |
| SCHEMBL28435846 | 0.88 | AOC3 (0.38) | SCDMAPTHDAC3HDAC8NCOR2 | |
| SCHEMBL29441559 | 0.88 | AOC3 (0.38) | SCDMAPTHDAC3HDAC8NCOR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111434662-B | Haloallylamine compound and application thereof | 药捷安康(南京)科技股份有限公司 | 2023-01-10 | — | — | CN | disclosed |
| EP-3892621-A1 | HALOALLYLAMINE COMPOUNDS AND APPLICATION THEREOF | Nanjing Transthera Biosciences Co., Ltd. (CN) | 2021-10-13 | — | — | EP | disclosed |
| CN-111434662-A | Haloallylamine compound and application thereof | 南京药捷安康生物科技有限公司 | 2020-07-21 | — | — | CN | disclosed |