Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 16/20 | 0.35 |
| ▸ | TNKS | O95271 | 2/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4386979 | 0.90 | GSK3B (0.38) | GSK3BTNKSTNKS2NAMPTCYP3A4 | |
| SCHEMBL4384596 | 0.88 | GSK3B (0.37) | GSK3BTNKSTNKS2NAMPTCYP3A4 | |
| SCHEMBL4383569 | 0.88 | GSK3B (0.37) | GSK3BTNKSTNKS2CYP3A4CYP2D6 | |
| SCHEMBL3398498 | 0.82 | GSK3B (0.38) | GSK3BCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL3664250 | 0.81 | GSK3B (0.43) | GSK3BCYP2D6 | |
| SCHEMBL4387983 | 0.80 | NAMPT (0.36) | GSK3BNAMPT | |
| SCHEMBL3402173 | 0.79 | GSK3B (0.45) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL4386475 | 0.77 | HPGD (0.38) | GSK3BNAMPT | |
| SCHEMBL3399573 | 0.77 | GSK3B (0.44) | GSK3BCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL3403548 | 0.77 | GSK3B (0.34) | GSK3BCYP2D6CYP1A2 |
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-2247598-A1 | SUBSTITUTED HETEROARYLAMIDE OXAZEPINOPYRIMIDONE DERIVATIVES | Sanofi-Aventis (FR) | 2010-11-10 | — | — | EP | claimed |
| WO-2009095787-A1 | SUBSTITUTED HETEROARYLAMIDE OXAZEPINOPYRIMIDONE DERIVATIVES | SANOFI-AVENTIS (FR) | 2009-08-06 | — | — | WO | claimed |