Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 17/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.37 |
| ▸ | PRKACA | P17612 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PRKCG | P05129 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | PRKX | P51817 | 1/20 | 0.37 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.37 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.37 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | SGK2 | Q9HBY8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3579248 | 0.89 | GSK3B (0.46) | GSK3BCYP2D6 | |
| SCHEMBL3567777 | 0.88 | GSK3B (0.46) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL3564980 | 0.86 | GSK3B (0.45) | GSK3BCYP3A4CYP2D6CYP1A2ROCK1 | |
| SCHEMBL3561454 | 0.77 | GSK3B (0.43) | GSK3BCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL3579597 | 0.76 | GSK3B (0.43) | GSK3BCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL3568860 | 0.76 | GSK3B (0.51) | GSK3BCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL3564721 | 0.76 | GSK3B (0.40) | GSK3BCYP2D6 | |
| SCHEMBL3564441 | 0.75 | GSK3B (0.46) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL3575296 | 0.75 | GSK3B (0.44) | GSK3BCYP2D6CYP1A2 | |
| SCHEMBL3575298 | 0.75 | GSK3B (0.44) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7781440-B2 | Use of substituted 2-pyrimidinyl-6,7,8,9-tetrahydropyrimido[1,2-a] pyrimidin-4-one and 7-pyrimidinyl-2,3-dihydroimidazo[1,2-a] pyrimidin-5(1H)one derivatives | SANOFI-AVENTIS (FR) | 2010-08-24 | — | — | US | claimed |