Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 16/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.56 |
| ▸ | HRH1 | P35367 | 5/20 | 0.48 |
| ▸ | DRD2 | P14416 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | DRD5 | P21918 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL735244 | 0.91 | CACNA1B (0.47) | HRH3KCNH2HRH1ALDH1A1MAPT | |
| SCHEMBL738460 | 0.79 | HRH3 (0.59) | HRH3KCNH2HRH1 | |
| SCHEMBL736407 | 0.78 | HRH3 (0.58) | HRH3KCNH2HRH1DRD2DRD3 | |
| Trifluoroacetic Acid SCHEMBL736467 | 0.73 | CACNA1B (0.49) | HRH3KCNH2HRH1ALDH1A1MAPT | |
| SCHEMBL738421 | 0.73 | HRH3 (0.70) | HRH3KCNH2HRH1DRD2DRD3 | |
| SCHEMBL3586400 | 0.69 | HRH3 (0.68) | HRH3KCNH2HRH1ALDH1A1GAA | |
| SCHEMBL12050742 | 0.69 | HRH3 (1.00) | HRH3KCNH2HRH1ALDH1A1GAA | |
| SCHEMBL29190477 | 0.69 | TMEM97 (0.41) | TMEM97SIGMAR1GAA | |
| SCHEMBL3584179 | 0.69 | HRH3 (0.81) | HRH3KCNH2HRH1ALDH1A1GAA | |
| SCHEMBL13437926 | 0.69 | HRH3 (0.81) | HRH3KCNH2HRH1ALDH1A1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1892241-A1 | NOVEL PIPERIDINE DERIVATIVE | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2008-02-27 | — | — | EP | disclosed |