Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 4/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 3/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | WNT1 | P04628 | 1/20 | 0.33 |
| ▸ | CLK2 | P49760 | 1/20 | 0.33 |
| ▸ | CLK3 | P49761 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL18322880 | 0.87 | ROCK1 (0.43) | ROCK1HTR1AFDPSHRH3KCNH2 | |
| SCHEMBL18322859 | 0.87 | ROCK1 (0.45) | ROCK1HTR1AFDPSHRH3KCNH2 | |
| SCHEMBL18322981 | 0.81 | ROCK1 (0.43) | ROCK1HRH3ROCK2WNT1CLK2 | |
| SCHEMBL18322976 | 0.80 | ROCK1 (0.39) | ROCK1HTR1AFDPSHRH3KCNH2 | |
| SCHEMBL18318528 | 0.79 | MAPK7 (0.46) | ROCK1MAPK7FDPS | |
| SCHEMBL18322904 | 0.77 | GSK3B (0.42) | HTR1AHRH3KCNH2GSK3B | |
| SCHEMBL18318948 | 0.77 | ROCK1 (0.58) | ROCK1HRH3KCNH2GRM4ROCK2 | |
| SCHEMBL18322939 | 0.77 | GSK3B (0.43) | HTR1AHRH3WNT1CLK2CLK3 | |
| SCHEMBL18322916 | 0.77 | GSK3B (0.45) | WNT1CLK2CLK3GSK3BDYRK1A | |
| SCHEMBL18322840 | 0.76 | CARM1 (0.42) | ROCK1HTR1AFDPSHRH3 |
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-3310441-A1 | 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES | Cephalon, Inc. (US) | 2018-04-25 | — | — | EP | disclosed |
| WO-2016205633-A1 | 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES | CEPHALON, INC. (US) | 2016-12-22 | — | — | WO | disclosed |