Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKX | P51817 | 1/20 | 0.33 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.33 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 9/20 | 0.33 |
| ▸ | HTR1A | P08908 | 7/20 | 0.33 |
| ▸ | DRD2 | P14416 | 7/20 | 0.33 |
| ▸ | HTR1D | P28221 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | COMT | P21964 | 5/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 6/20 | 0.32 |
| ▸ | HTR6 | P50406 | 6/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7319331 | 0.78 | ROCK2 (0.35) | APEX1ROCK2PRKXPRKCEPRKCD | |
| SCHEMBL7327003 | 0.72 | ROCK2 (0.36) | APEX1ROCK2PRKXPRKCEPRKCD | |
| SCHEMBL9617966 | 0.68 | SMN1; SMN2 (0.67) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL5083072 | 0.67 | ROCK2 (0.49) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL7327006 | 0.67 | ROCK2 (0.39) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL7323632 | 0.66 | CHRM1 (0.36) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL4725363 | 0.66 | ROCK2 (0.48) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL7325032 | 0.66 | ROCK2 (0.36) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL7321039 | 0.66 | COMT (0.40) | ROCK2PRKXPRKCEPRKCDROCK1 | |
| SCHEMBL7735396 | 0.66 | CDK2 (0.62) | COMT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0287696-B1 | ISOQUINOLINE DERIVATIVES | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1991-01-02 | — | — | EP | disclosed |
| EP-0287696-A1 | Isoquinoline derivatives | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1988-10-26 | — | — | EP | disclosed |