Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 2/20 | 0.40 |
| ▸ | LSS | P48449 | 2/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ADH1C | P00326 | 1/20 | 0.33 |
| ▸ | ADH1A | P07327 | 1/20 | 0.33 |
| ▸ | ADH4 | P08319 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8640448 | 0.88 | GBA1 (0.48) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL8645252 | 0.88 | GBA1 (0.48) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL8646640 | 0.88 | GBA1 (0.48) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL8644516 | 0.88 | GBA1 (0.48) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL8115794 | 0.88 | GBA1 (0.48) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL8642669 | 0.86 | GBA1 (0.45) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL4431588 | 0.82 | GBA1 (0.41) | GBA1ALDH1A1TDP1EPHX2 | |
| SCHEMBL4805015 | 0.81 | KDM4E (0.38) | LSSDNM1ALDH1A1HTR1BHRH3 | |
| SCHEMBL7210755 | 0.80 | CHRM2 (0.35) | GBA1LSSS1PR2S1PR1S1PR3 | |
| SCHEMBL7210764 | 0.80 | EPHX2 (0.41) | GBA1LSSS1PR2S1PR1S1PR3 |
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-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | disclosed |