Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 20/20 | 0.69 |
| ▸ | PTGS1 | P23219 | 15/20 | 0.69 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7210283 | 0.89 | PTGS2 (0.77) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL7215278 | 0.88 | PTGS2 (0.79) | PTGS2PTGS1 | |
| SCHEMBL7211987 | 0.87 | PTGS2 (0.56) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL7210291 | 0.86 | PTGS2 (0.69) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL7215571 | 0.82 | PTGS2 (0.62) | PTGS2PTGS1 | |
| SCHEMBL5311980 | 0.81 | PTGS2 (0.64) | PTGS2PTGS1ALDH1A1 | |
| SCHEMBL3021555 | 0.81 | PTGS2 (0.77) | PTGS2PTGS1 | |
| SCHEMBL7210689 | 0.81 | PTGS2 (0.77) | PTGS2PTGS1 | |
| SCHEMBL7216255 | 0.80 | PTGS2 (0.64) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL8505457 | 0.79 | PTGS2 (0.48) | PTGS2PTGS1ABCB11ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1369415-A1 | Substituted pyrrolyl compounds for the treatment of inflammation | G.D. SEARLE & CO. (US) | 2003-12-10 | — | — | EP | disclosed |