Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 12/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 10/20 | 0.36 |
| ▸ | TNF | P01375 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28405789 | 0.94 | ROCK2 (0.40) | ROCK2ROCK1TNF | |
| SCHEMBL28408149 | 0.87 | ROCK2 (0.48) | ROCK2ROCK1 | |
| SCHEMBL23927707 | 0.86 | ROCK2 (0.44) | ROCK2ROCK1TNF | |
| SCHEMBL23927705 | 0.86 | ROCK2 (0.44) | ROCK2ROCK1TNF | |
| SCHEMBL23927557 | 0.85 | ROCK2 (0.43) | ROCK2ROCK1TNF | |
| SCHEMBL23927560 | 0.85 | ROCK2 (0.43) | ROCK2ROCK1TNF | |
| SCHEMBL23927628 | 0.85 | ROCK2 (0.49) | ROCK2ROCK1TNF | |
| SCHEMBL23927630 | 0.85 | ROCK2 (0.49) | ROCK2ROCK1TNF | |
| SCHEMBL28405788 | 0.81 | ROCK2 (0.55) | ROCK2ROCK1TNF | |
| SCHEMBL23927682 | 0.80 | ROCK2 (0.44) | ROCK2ROCK1TNF |
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-111217834-B | Nitroxide derivatives of ROCK kinase inhibitors | 维眸生物科技（上海）有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-111217834-A | Nitroxide derivatives of ROCK kinase inhibitors | 维眸生物科技（上海）有限公司 | 2020-06-02 | — | — | CN | disclosed |