Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | ELANE | P08246 | 7/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.44 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | PRKCA | P17252 | 1/20 | 0.42 |
| ▸ | GRK2 | P25098 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4854027 | 0.93 | GSK3B (0.58) | GSK3BNAMPTELANECYP2C9MAPK8 | |
| Trifluoroacetic Acid SCHEMBL5657353 | 0.89 | GSK3B (0.58) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5658704 | 0.88 | GSK3B (0.67) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5655822 | 0.88 | GSK3B (0.59) | GSK3BNAMPTCASP1ROCK2PRKCA | |
| Trifluoroacetic Acid SCHEMBL5657173 | 0.87 | GSK3B (0.58) | GSK3BNAMPTCYP2C9CASP1ROCK2 | |
| Trifluoroacetic Acid SCHEMBL5656445 | 0.86 | GSK3B (0.55) | GSK3BROCK2PRKCAGRK2KDM4E | |
| Trifluoroacetic Acid SCHEMBL5656836 | 0.85 | GSK3B (0.56) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5657178 | 0.85 | GSK3B (0.58) | GSK3BCYP2C9CASP1ROCK2PRKCA | |
| Trifluoroacetic Acid SCHEMBL5657921 | 0.84 | GSK3B (0.62) | GSK3BCASP1ROCK2PRKCAGRK2 | |
| Trifluoroacetic Acid SCHEMBL5659768 | 0.84 | GSK3B (0.64) | GSK3BCYP2C9CASP1ROCK2PRKCA |
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 |