Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 18/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3401659 | 0.97 | GSK3B (0.39) | GSK3BCYP2D6CYP1A2CYP3A4SCD | |
| SCHEMBL3406372 | 0.89 | CGAS (0.37) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL2065745 | 0.85 | KDM4E (0.40) | GSK3BCYP2D6CYP1A2CYP3A4 | |
| SCHEMBL2066076 | 0.84 | GSK3B (0.47) | GSK3BCYP2D6CYP1A2CYP3A4SCD | |
| SCHEMBL2066088 | 0.82 | GSK3B (0.40) | GSK3BCYP2D6CYP1A2CYP3A4SCD | |
| SCHEMBL2065434 | 0.82 | GSK3B (0.45) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL4379543 | 0.81 | CYP1A2 (0.38) | GSK3BCYP2D6CYP1A2CYP3A4 | |
| SCHEMBL2065426 | 0.81 | DRD4 (0.42) | GSK3B | |
| SCHEMBL2065082 | 0.80 | GSK3B (0.39) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL4383569 | 0.80 | GSK3B (0.37) | GSK3BCYP2D6CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1957492-B1 | SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES | SANOFI AVENTIS (FR) | 2010-11-10 | — | — | EP | claimed |