Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.59 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | WDR5 | P61964 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | GRK2 | P25098 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.39 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5240909 | 0.94 | GSK3B (0.66) | GSK3BCASP1WDR5MAPK1ROCK2 | |
| Trifluoroacetic Acid SCHEMBL5657921 | 0.92 | GSK3B (0.62) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5657375 | 0.89 | GSK3B (0.59) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5658704 | 0.88 | GSK3B (0.67) | GSK3BCASP1MAPK1ROCK2PRKCA | |
| Trifluoroacetic Acid SCHEMBL5659768 | 0.86 | GSK3B (0.64) | GSK3BCASP1MAPK1ROCK2PRKCA | |
| Trifluoroacetic Acid SCHEMBL5655822 | 0.86 | GSK3B (0.59) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| SCHEMBL4847300 | 0.85 | GSK3B (0.60) | GSK3BCASP1WDR5MAPK1ROCK2 | |
| SCHEMBL5229735 | 0.85 | GSK3B (0.69) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5660695 | 0.85 | GSK3B (0.73) | GSK3BCASP1MAPK1ROCK2MAPK3 | |
| Trifluoroacetic Acid SCHEMBL5656429 | 0.85 | GSK3B (0.64) | GSK3BCASP1ROCK2PRKCAGRK2 |
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-7309701-B2 | Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2007-12-18 | — | — | US | disclosed |