Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 5/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.44 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.44 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 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 | |
|---|---|---|---|---|
| SCHEMBL432884 | 0.85 | ROCK1 (0.50) | ROCK1ROCK2CNR2HDAC4HDAC7 | |
| SCHEMBL14393867 | 0.85 | ROCK1 (0.52) | ROCK1ROCK2CNR2HDAC4HDAC7 | |
| SCHEMBL14393694 | 0.85 | ROCK1 (0.52) | ROCK1ROCK2CNR2HDAC4HDAC7 | |
| SCHEMBL16901655 | 0.84 | MAPK1 (0.46) | RIPK1MAPK1GPR139 | |
| SCHEMBL18765697 | 0.84 | CYP26A1 (0.47) | ROCK2SLC6A9SLC6A5CYP26A1RIPK1 | |
| SCHEMBL29675785 | 0.84 | CYP26A1 (0.47) | ROCK2SLC6A9SLC6A5CYP26A1RIPK1 | |
| SCHEMBL31037006 | 0.84 | MAPK1 (0.46) | RIPK1MAPK1GPR139 | |
| SCHEMBL29751787 | 0.84 | MAPK1 (0.46) | RIPK1MAPK1GPR139 | |
| SCHEMBL23100732 | 0.83 | ROCK1 (0.53) | ROCK1ROCK2CNR2HDAC4HDAC7 | |
| SCHEMBL3585946 | 0.83 | ROCK1 (0.53) | ROCK1ROCK2CNR2HDAC4HDAC7 |
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-118561801-A | Benzo [ d ] [1,3] dioxoles compound, preparation method and application thereof | 上海医药集团股份有限公司 | 2024-08-30 | — | — | CN | disclosed |