Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8188503 | 0.94 | PTGS2 (0.40) | PTGS2PTGS1PTGDR2MAPK14CA2 | |
| SCHEMBL8197292 | 0.89 | PTGS2 (0.40) | PTGS2PTGS1PTGDR2CA2ALDH1A1 | |
| SCHEMBL8199737 | 0.87 | PTGS2 (0.40) | PTGS2PTGS1PTGDR2CA2ALDH1A1 | |
| SCHEMBL8188078 | 0.86 | PTGS2 (0.41) | PTGS2PTGS1MAPK14CA2ALDH1A1 | |
| SCHEMBL8196142 | 0.85 | PTGS2 (0.37) | PTGS2PTGS1PTGDR2CA2ALDH1A1 | |
| SCHEMBL8195776 | 0.84 | CA2 (0.41) | PTGS2PTGS1CA2 | |
| SCHEMBL8201297 | 0.84 | L3MBTL1 (0.37) | PTGS2MAPK14CA2ALDH1A1 | |
| SCHEMBL8196138 | 0.84 | PTGS2 (0.36) | PTGS2PTGS1MAPK14 | |
| SCHEMBL8196899 | 0.83 | PTGS2 (0.39) | PTGS2PTGS1PTGDR2CA2ALDH1A1 | |
| SCHEMBL8200031 | 0.81 | PTGS2 (0.39) | PTGS2PTGS1PTGDR2CA2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | disclosed |