Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 20/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3578479 | 1.00 | GSK3B (0.44) | GSK3BCYP2D6CYP1A2CSNK1A1GSK3A | |
| SCHEMBL3569777 | 0.91 | GSK3B (0.42) | GSK3BCYP2D6 | |
| SCHEMBL3564705 | 0.91 | GSK3B (0.42) | GSK3BCYP2D6 | |
| SCHEMBL3564702 | 0.91 | GSK3B (0.42) | GSK3BCYP2D6 | |
| SCHEMBL3565826 | 0.89 | GSK3B (0.46) | GSK3BCYP2D6CYP1A2GSK3A | |
| SCHEMBL3565828 | 0.89 | GSK3B (0.46) | GSK3BCYP2D6CYP1A2GSK3A | |
| SCHEMBL3570860 | 0.88 | GSK3B (0.39) | GSK3BCYP2D6 | |
| SCHEMBL3570861 | 0.88 | GSK3B (0.39) | GSK3BCYP2D6 | |
| SCHEMBL3579567 | 0.86 | GSK3B (0.41) | GSK3BCYP2D6 | |
| SCHEMBL3572036 | 0.86 | GSK3B (0.39) | GSK3BCYP2D6 |
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 |