Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 18/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 11/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7490892 | 0.91 | PTGS2 (0.50) | PTGS2PTGS1 | |
| SCHEMBL6329140 | 0.88 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL7487145 | 0.85 | PTGS2 (0.53) | PTGS2PTGS1 | |
| SCHEMBL7487950 | 0.82 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL5142204 | 0.80 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL7485513 | 0.79 | PTGS2 (0.61) | PTGS2PTGS1 | |
| SCHEMBL7485570 | 0.77 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL8451853 | 0.74 | PTGS2 (0.45) | PTGS2PTGS1 | |
| SCHEMBL7488141 | 0.72 | PTGS2 (0.51) | PTGS2PTGS1 | |
| SCHEMBL6259699 | 0.70 | PTGS2 (0.54) | PTGS2PTGS1 |
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-6057319-A | CYCLOOXYGENASE-2 INHIBITORS; NON-STEROIDAL ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA & CO. (CA) | 2000-05-02 | — | — | US | disclosed |