Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 18/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4217866 | 0.86 | GSK3B (0.42) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL3658705 | 0.85 | GSK3B (0.57) | GSK3BCYP2D6 | |
| SCHEMBL4209348 | 0.84 | GSK3B (0.50) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL2065267 | 0.83 | GSK3B (0.42) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL2065131 | 0.81 | PRKCD (0.42) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL2064259 | 0.80 | GSK3B (0.43) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL915676 | 0.80 | GSK3B (0.44) | GSK3BCYP1A2 | |
| SCHEMBL4210663 | 0.79 | GSK3B (0.48) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL3658358 | 0.78 | GSK3B (0.52) | GSK3B | |
| SCHEMBL927707 | 0.78 | GSK3B (0.41) | GSK3BCYP1A2CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2238140-B1 | SUBSTITUTED HETEROARYLAMIDE DIAZEPINOPYRIMIDONE DERIVATIVES | SANOFI SA (FR) | 2013-07-17 | — | — | EP | claimed |
| EP-2090579-A1 | Substituted heteroarylamide diazepinopyrimidone derivatives | Sanofi-Aventis (FR) | 2009-08-19 | — | — | EP | claimed |
| US-8507475-B2 | Substituted heteroarylamide diazepinopyrimidone derivatives | SANOFI (FR) | 2013-08-13 | — | — | US | disclosed |
| EP-2238140-B1 | SUBSTITUTED HETEROARYLAMIDE DIAZEPINOPYRIMIDONE DERIVATIVES | SANOFI SA (FR) | 2013-07-17 | — | — | EP | disclosed |
| EP-2090579-A1 | Substituted heteroarylamide diazepinopyrimidone derivatives | Sanofi-Aventis (FR) | 2009-08-19 | — | — | EP | disclosed |