Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KIF18A | Q8NI77 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.30 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.30 |
| ▸ | COMT | P21964 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316955 | 0.84 | CA12 (0.36) | MAPTCOMT | |
| SCHEMBL7327000 | 0.81 | CDK2 (0.31) | ROCK2ROCK1 | |
| SCHEMBL7317793 | 0.81 | SLC18A3 (0.32) | — | |
| SCHEMBL7328987 | 0.75 | COMT (0.35) | MAPTCOMT | |
| SCHEMBL7325041 | 0.74 | ROCK2 (0.36) | HTR1ADRD2HTR2AHTR7HTR6 | |
| SCHEMBL7324785 | 0.73 | ROCK2 (0.30) | ROCK2ROCK1 | |
| SCHEMBL7321039 | 0.72 | COMT (0.40) | HTR1ADRD2HTR2AHTR7HTR6 | |
| SCHEMBL7326975 | 0.72 | CHRM1 (0.40) | MAPTHTR6ROCK2ROCK1COMT | |
| SCHEMBL7360629 | 0.72 | CHRM1 (0.38) | MAPT | |
| SCHEMBL7327070 | 0.70 | ROCK2 (0.49) | ROCK2ROCK1 |
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 |