Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 12/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30744194 | 0.92 | ROCK2 (0.43) | ROCK2ROCK1GAAALDH1A1L3MBTL1 | |
| SCHEMBL23501411 | 0.92 | ROCK2 (0.43) | ROCK2ROCK1GAAALDH1A1L3MBTL1 | |
| SCHEMBL28915354 | 0.92 | ROCK2 (0.44) | ROCK2ROCK1ALDH1A1MEN1HTT | |
| SCHEMBL23501278 | 0.92 | ROCK2 (0.44) | ROCK2ROCK1ALDH1A1MEN1HTT | |
| SCHEMBL30744184 | 0.92 | ROCK2 (0.44) | ROCK2ROCK1ALDH1A1MEN1HTT | |
| SCHEMBL23501445 | 0.91 | ROCK2 (0.36) | ROCK2ROCK1GAAALDH1A1L3MBTL1 | |
| SCHEMBL30744207 | 0.91 | ROCK2 (0.36) | ROCK2ROCK1GAAALDH1A1L3MBTL1 | |
| SCHEMBL30744209 | 0.91 | ALDH1A1 (0.39) | ROCK2ROCK1GAAALDH1A1L3MBTL1 | |
| SCHEMBL23501294 | 0.91 | ALDH1A1 (0.39) | ROCK2ROCK1GAAALDH1A1L3MBTL1 | |
| SCHEMBL23501355 | 0.90 | ROCK2 (0.44) | ROCK2ROCK1GAANAMPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3901156-A1 | NITROOXYDERIVATIVE OF ROCK KINASE INHIBITOR | Vivavision (Shanghai) Ltd (CN) | 2021-10-27 | — | — | EP | disclosed |
| 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 |