Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.67 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.67 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.60 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9206892 | 0.89 | PTGS2 (0.68) | PTGS2PTGS1AOC3ALOX5CYP2C9 | |
| SCHEMBL17369623 | 0.89 | PTGS2 (0.68) | PTGS2PTGS1CHRNA7CA1CA2 | |
| SCHEMBL3864003 | 0.88 | PTGS2 (0.78) | PTGS2PTGS1AOC3ALOX5CYP2C9 | |
| SCHEMBL9209865 | 0.88 | PTGS2 (0.67) | PTGS2PTGS1AOC3ALOX5CYP2C9 | |
| SCHEMBL3871425 | 0.88 | PTGS2 (0.67) | PTGS2PTGS1AOC3ALOX5CYP2C9 | |
| SCHEMBL9941738 | 0.88 | PTGS2 (0.77) | PTGS2PTGS1ALOX5CA1CA2 | |
| Hydrochloric Acid SCHEMBL9204664 | 0.85 | PTGS2 (0.63) | PTGS2PTGS1AOC3ALOX5CYP2C9 | |
| SCHEMBL9201743 | 0.84 | PTGS2 (0.71) | PTGS2PTGS1AOC3ALOX5CYP2C9 | |
| SCHEMBL17378009 | 0.83 | PTGS2 (0.54) | PTGS2PTGS1ALOX5CYP2C9CHRNA7 | |
| SCHEMBL9209960 | 0.83 | AOC3 (0.64) | PTGS2PTGS1AOC3ALOX5CHRNA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0418845-B1 | Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO (JP) | 1995-08-09 | — | — | EP | disclosed |
| US-5134142-A | PYRAZOLE DERIVATIVES, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-07-28 | — | — | US | disclosed |
| EP-0418845-A1 | Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-03-27 | — | — | EP | disclosed |