Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 16/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 10/20 | 0.57 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8688818 | 0.92 | PTGS2 (0.56) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8385316 | 0.92 | PTGS2 (0.69) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8693379 | 0.91 | PTGS2 (0.69) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8625458 | 0.87 | PTGS2 (0.67) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL7055102 | 0.85 | PTGS2 (0.64) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8688953 | 0.85 | PTGS2 (0.49) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8688704 | 0.84 | PTGS2 (0.51) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8525009 | 0.84 | PTGS2 (0.65) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8637047 | 0.83 | PTGS2 (0.63) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8639264 | 0.83 | PTGS2 (0.69) | 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 3 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 | claimed |
| 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 |