Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 10/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 2/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.35 |
| ▸ | PIM1 | P11309 | 2/20 | 0.35 |
| ▸ | PRKACA | P17612 | 2/20 | 0.35 |
| ▸ | HIPK2 | Q9H2X6 | 2/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | VCP | P55072 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3375649 | 0.76 | GSK3B (0.40) | GSK3BCYP2C9CYP1A2CYP2D6CDC7 | |
| SCHEMBL2067123 | 0.75 | ROCK1 (0.43) | GSK3BCYP2C9ROCK2 | |
| SCHEMBL2065004 | 0.75 | PRKACA (0.47) | GSK3BCDC7MAP4K4PIM1PRKACA | |
| SCHEMBL2065131 | 0.74 | PRKCD (0.42) | GSK3BCYP1A2CYP2D6CDC7MAP4K4 | |
| SCHEMBL2065101 | 0.72 | GSK3B (0.39) | GSK3BCYP2C9CYP1A2CYP2D6SCD | |
| SCHEMBL4380859 | 0.72 | GSK3B (0.40) | GSK3BCYP2C9CYP1A2CYP2D6CDC7 | |
| SCHEMBL1831028 | 0.72 | GSK3B (0.46) | GSK3BCYP1A2CYP2D6CDC7MAP4K4 | |
| SCHEMBL2066118 | 0.71 | ALDH1A1 (0.43) | GSK3BCYP1A2ALDH1A1GRM5 | |
| SCHEMBL2065321 | 0.71 | KDM4E (0.43) | — | |
| SCHEMBL2064259 | 0.71 | GSK3B (0.43) | GSK3BCYP2C9CYP1A2CYP2D6CDC7 |
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 |
|---|---|---|---|---|---|---|---|
| US-8148364-B2 | Substituted bicyclic pyrimidone derivatives | SANOFI-AVENTIS (FR) | 2012-04-03 | — | — | US | claimed |
| US-8148364-B2 | Substituted bicyclic pyrimidone derivatives | SANOFI-AVENTIS (FR) | 2012-04-03 | — | — | US | disclosed |