Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 11/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL8639807 | 0.84 | PTGS2 (0.43) | PTGS2PTGS1PTGESTRPC3CYP2C9 | |
| SCHEMBL8637389 | 0.84 | PTGS2 (0.53) | PTGS2PTGS1PTGESTRPC3CYP2C9 | |
| SCHEMBL8733794 | 0.83 | PTGS2 (0.38) | PTGS2PTGS1KDM4EALDH1A1ALOX5 | |
| SCHEMBL8644138 | 0.82 | PTGS2 (0.42) | PTGS2PTGS1PTGESTRPC3CYP2C9 | |
| SCHEMBL726057 | 0.81 | PTGES (0.53) | PTGS2PTGS1PTGESTRPC3CYP2C9 | |
| SCHEMBL8688565 | 0.81 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL8689245 | 0.80 | PTGS2 (0.43) | PTGS2PTGS1KDM4E | |
| SCHEMBL8692114 | 0.80 | PTGDR2 (0.40) | PTGS2PTGS1 | |
| SCHEMBL8688934 | 0.78 | PTGS2 (0.40) | PTGS2PTGS1KDM4E | |
| SCHEMBL8639293 | 0.78 | PTGS2 (0.54) | PTGS2PTGS1PTGES |
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 |
|---|---|---|---|---|---|---|---|
| US-5760068-A | NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G.D. SEARLE & CO. (US) | 1998-06-02 | — | — | US | disclosed |
| US-5756529-A | ANTIINFLAMMATORY | G.D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |