Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 15/20 | 0.78 |
| ▸ | PTGS2 | P35354 | 14/20 | 0.71 |
| ▸ | CA1 | P00915 | 3/20 | 0.69 |
| ▸ | CA2 | P00918 | 3/20 | 0.69 |
| ▸ | CA9 | Q16790 | 3/20 | 0.69 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.68 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL24398220 | 0.91 | EPHX2 (0.79) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL9937759 | 0.87 | EPHX2 (1.00) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL15460602 | 0.85 | EPHX2 (0.71) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL3248374 | 0.84 | CA1 (0.87) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL15460598 | 0.84 | EPHX2 (0.88) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL9938576 | 0.84 | EPHX2 (1.00) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL9938872 | 0.84 | EPHX2 (0.80) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL15455650 | 0.83 | CA1 (0.77) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL9938352 | 0.83 | EPHX2 (1.00) | EPHX2PTGS2CA1CA2CA9 | |
| SCHEMBL15460596 | 0.82 | EPHX2 (0.85) | EPHX2PTGS2CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012082647-A2 | PYRAZOLE INHIBITORS OF COX-2 AND sEH | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2012-06-21 | — | — | WO | disclosed |