Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 18/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5698695 | 0.89 | PTGS2 (0.64) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL8421061 | 0.83 | PTGS2 (0.88) | PTGS2PTGS1CYP2C9AOC3 | |
| SCHEMBL13236931 | 0.79 | PTGS2 (0.65) | PTGS2PTGS1CYP2C9CA1CA2 | |
| SCHEMBL9201584 | 0.79 | PTGS2 (0.63) | PTGS2PTGS1CA1CA2AOC3 | |
| SCHEMBL9200362 | 0.79 | PTGS2 (0.63) | PTGS2PTGS1CA1CA2AOC3 | |
| SCHEMBL5229949 | 0.79 | PTGS2 (1.00) | PTGS2PTGS1CYP2C9CA1CA2 | |
| Sc-58125 SCHEMBL12375146 | 0.79 | PTGS2 (1.00) | PTGS2PTGS1CYP2C9CA1CA2 | |
| Sc-58125 SCHEMBL214120 | 0.79 | PTGS2 (1.00) | PTGS2PTGS1CYP2C9CA1CA2 | |
| SCHEMBL9210964 | 0.78 | PTGS2 (0.65) | PTGS2PTGS1CA1CA2AOC3 | |
| SCHEMBL8423953 | 0.78 | PTGS2 (0.79) | PTGS2PTGS1AOC3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0843549-B1 | COMPOSITIONS COMPRISING A CYCLOOXYGENASE-2 INHIBITOR AND A LEUKOTRIENE A 4 HYDROLASE INHIBITOR | SEARLE & CO (US) | 2006-04-12 | — | — | EP | claimed |
| US-5475018-A | Antiinflammatory agent, antiarthritic agent; analgesics and antipyretics | G. D. SEARLE & CO. (US) | 1995-12-12 | — | — | US | disclosed |