Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA9 | Q16790 | 3/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 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 | |
|---|---|---|---|---|
| SCHEMBL6340631 | 0.95 | PTGS2 (0.65) | PTGS2PTGS1ABCB11ALDH1A1CA1 | |
| SCHEMBL9053327 | 0.93 | PTGS2 (0.55) | PTGS2CYP2C9PTGS1ABCB11ALDH1A1 | |
| SCHEMBL6341657 | 0.86 | PTGS2 (0.78) | PTGS2CYP2C9PTGS1CA1CA2 | |
| SCHEMBL6341186 | 0.84 | PTGS2 (0.69) | PTGS2PTGS1ABCB11ALDH1A1 | |
| SCHEMBL6340846 | 0.84 | PTGS2 (0.75) | PTGS2PTGS1CA1CA2CA9 | |
| SCHEMBL7867795 | 0.83 | PTGS2 (0.53) | PTGS2CYP2C9PTGS1 | |
| SCHEMBL8689101 | 0.82 | PTGS2 (0.42) | PTGS2PTGS1ABCB11ALDH1A1CA1 | |
| SCHEMBL6341745 | 0.81 | PTGS2 (0.78) | PTGS2CYP2C9PTGS1CA1CA2 | |
| SCHEMBL6350193 | 0.79 | PTGS2 (0.78) | PTGS2CYP2C9PTGS1ABCB11CA1 | |
| SCHEMBL17456918 | 0.78 | PTGS2 (0.75) | PTGS2CYP2C9PTGS1ABCB11CA1 |
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-0731795-A1 | SUBSTITUTED PYRAZOLYL BENZENESULFONAMIDES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-09-18 | — | — | EP | claimed |