Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | GCGR | P47871 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 6/20 | 0.41 |
| ▸ | CA2 | P00918 | 6/20 | 0.41 |
| ▸ | CA9 | Q16790 | 5/20 | 0.40 |
| ▸ | CA12 | O43570 | 4/20 | 0.40 |
| ▸ | CA7 | P43166 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 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 | |
|---|---|---|---|---|
| SCHEMBL8175431 | 0.90 | ALDH1A1 (0.43) | PTGS2PTGS1GCGRALDH1A1HPGD | |
| SCHEMBL8181133 | 0.85 | CDC25B (0.53) | PTGS2PTGS1CA1CA2CA9 | |
| SCHEMBL8179843 | 0.82 | CA1 (0.55) | PTGS2PTGS1TTKCA1CA2 | |
| SCHEMBL7773067 | 0.81 | PTGS2 (0.47) | PTGS2PTGS1TTKCA1CA2 | |
| SCHEMBL7778249 | 0.81 | PTGS2 (0.52) | PTGS2PTGS1TTKCA1CA2 | |
| SCHEMBL7779394 | 0.81 | CA1 (0.54) | PTGS2CA1CA2CA9CA12 | |
| SCHEMBL8174619 | 0.80 | CA1 (0.46) | PTGS2PTGS1TTKCA1CA2 | |
| SCHEMBL7772912 | 0.79 | CA1 (0.52) | PTGS2PTGS1TTKCA1CA2 | |
| SCHEMBL8632186 | 0.79 | CA1 (0.51) | PTGS2PTGS1TTKALDH1A1CA1 | |
| SCHEMBL7777129 | 0.77 | PTGS2 (0.42) | PTGS2PTGS1TTKCA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6028072-A | 3,4-substituted pyrazoles for the treatment of inflammation | G. D. SEARLE & CO. (US) | 2000-02-22 | — | — | US | disclosed |
| US-5486534-A | 3,4-substituted pyrazoles for the treatment of inflammation | G. D. SEARLE & CO. (US) | 1996-01-23 | — | — | US | disclosed |