Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.33 |
| ▸ | EEF2K | O00418 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD1 | P21728 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | DRD5 | P21918 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6325320 | 0.85 | CCR5 (0.37) | GRIN1GRIN2BCCR5ALDH1A1EPHX2 | |
| SCHEMBL6323809 | 0.83 | CCR5 (0.36) | GRIN1GRIN2BCCR5ALDH1A1EPHX2 | |
| SCHEMBL6317205 | 0.82 | GRIN2B (0.51) | GRIN1GRIN2BALDH1A1KDM4EGAA | |
| SCHEMBL6316829 | 0.81 | GRIN1 (0.38) | GRIN1GRIN2BCCR5ALDH1A1EPHX2 | |
| SCHEMBL6316782 | 0.81 | GRIN1 (0.38) | GRIN1GRIN2BCCR5ALDH1A1EPHX2 | |
| SCHEMBL6609294 | 0.81 | GRIN1 (0.37) | GRIN1GRIN2BEPHX2HTT | |
| SCHEMBL6620819 | 0.78 | GRIN2B (0.43) | GRIN1GRIN2BALDH1A1KDM4EGAA | |
| SCHEMBL6620971 | 0.76 | HRH1 (0.41) | GRIN1GRIN2BCCR5ALDH1A1KDM4E | |
| SCHEMBL6621946 | 0.75 | MMP12 (0.50) | ALDH1A1L3MBTL1FAAHCACNA1FHTR1A | |
| SCHEMBL6622630 | 0.74 | MEN1 (0.53) | GRIN1GRIN2BALDH1A1KDM4EMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1192154-B1 | BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS | ASTRAZENECA AB (SE) | 2004-03-17 | — | — | EP | claimed |
| US-6887881-B1 | Bispidine compounds useful in the treatment of cardiac arrythmias | ASTRAZENECA AB (SE) | 2005-05-03 | — | — | US | disclosed |
| EP-1192154-B1 | BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS | ASTRAZENECA AB (SE) | 2004-03-17 | — | — | EP | disclosed |