Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4971731 | 0.76 | HRH2 (0.33) | — | |
| SCHEMBL4973854 | 0.76 | SIGMAR1 (0.34) | CHRM5CHRM3SIGMAR1ALDH1A1HTT | |
| SCHEMBL4972298 | 0.72 | CHRM5 (0.34) | CHRM5CHRM3SIGMAR1 | |
| SCHEMBL4595956 | 0.72 | MMP8 (0.39) | MMP8 | |
| SCHEMBL4596451 | 0.72 | MMP8 (0.39) | MMP8 | |
| SCHEMBL22235513 | 0.71 | SIGMAR1 (0.41) | CHRM5CHRM3SIGMAR1ALDH1A1HTT | |
| SCHEMBL22557833 | 0.67 | SIGMAR1 (0.45) | CHRM5CHRM3SIGMAR1ALDH1A1HTT | |
| SCHEMBL5381690 | 0.66 | SIGMAR1 (0.41) | CHRM5CHRM3SIGMAR1ALDH1A1HTT | |
| SCHEMBL29057665 | 0.66 | CHRM5 (0.43) | CHRM5CHRM3SIGMAR1ALDH1A1MEN1 | |
| SCHEMBL2637094 | 0.64 | FFAR1 (0.44) | CHRM5CHRM3SIGMAR1ALDH1A1HTT |
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-1968590-A2 | NOVEL COMPOUNDS | SmithKline Beecham Corporation (US) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007070865-A2 | PIPERAZINE COMPOUNDS AS AGONISTS OF TRPV4 CHANNEL RECEPTORS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-06-21 | — | — | WO | disclosed |