Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.35 |
| ▸ | HTR6 | P50406 | 4/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.34 |
| ▸ | HRH1 | P35367 | 3/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.34 |
| ▸ | HTR7 | P34969 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7320739 | 0.84 | CHRM1 (0.40) | CHRM1ROCK2ROCK1HTR6HTR7 | |
| SCHEMBL7321035 | 0.80 | ROCK2 (0.35) | ROCK2ROCK1HTR6HTR7 | |
| SCHEMBL5083135 | 0.71 | CHRM1 (0.43) | CHRM1ROCK2ROCK1MEN1TP53 | |
| SCHEMBL7360633 | 0.71 | CHRM1 (0.38) | CHRM1ROCK2ROCK1HTR6CYP3A4 | |
| SCHEMBL7323647 | 0.71 | ROCK2 (0.39) | CHRM1ROCK2ROCK1HTR6ADRA1B | |
| SCHEMBL7327658 | 0.70 | CHRM1 (0.44) | CHRM1ROCK2ROCK1HTR6HTR7 | |
| SCHEMBL7328994 | 0.69 | GAA (0.33) | ROCK2ROCK1HTR7 | |
| SCHEMBL7325032 | 0.68 | ROCK2 (0.36) | ROCK2ROCK1HTR7 | |
| SCHEMBL4726186 | 0.68 | CHRM1 (0.47) | CHRM1ROCK2ROCK1MEN1TP53 | |
| SCHEMBL7323632 | 0.68 | CHRM1 (0.36) | CHRM1ROCK2ROCK1HTR6 |
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 |