Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 17/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL697678 | 1.00 | GSK3B (0.54) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL698334 | 1.00 | GSK3B (0.54) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL697697 | 1.00 | GSK3B (0.54) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL696903 | 0.88 | GSK3B (0.55) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL697971 | 0.88 | GSK3B (0.55) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL697355 | 0.87 | GSK3B (0.61) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL697896 | 0.87 | GSK3B (0.61) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL8232347 | 0.87 | GSK3B (0.55) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL695834 | 0.87 | GSK3B (0.55) | GSK3BCYP1A2CYP2D6 | |
| SCHEMBL13711312 | 0.85 | GSK3B (0.61) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2423207-A2 | 2-(cyclic amino)-pyrimidone derivatives as TPK1 inhibitors | Mitsubishi Tanabe Pharma Corporation (JP) | 2012-02-29 | — | — | EP | disclosed |