Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.47 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | CD74 | P04233 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7573854 | 0.92 | PTGS2 (0.49) | PTGS2PTGS1ADAMTS4MMP13CA1 | |
| SCHEMBL7570401 | 0.86 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL7568518 | 0.86 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL7568513 | 0.86 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL7570406 | 0.86 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL7568732 | 0.79 | PTGS2 (0.51) | PTGS2PTGS1 | |
| SCHEMBL7568735 | 0.79 | PTGS2 (0.51) | PTGS2PTGS1 | |
| SCHEMBL7567226 | 0.76 | PTGS2 (0.67) | PTGS2PTGS1 | |
| SCHEMBL7567230 | 0.76 | PTGS2 (0.67) | PTGS2PTGS1 | |
| SCHEMBL7569113 | 0.74 | PTGS2 (0.53) | PTGS2PTGS1ADAMTS4 |
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-0889878-B1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2002-09-04 | — | — | EP | claimed |