Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 12/20 | 0.50 |
| ▸ | CA12 | O43570 | 5/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA4 | P22748 | 4/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8168023 | 1.00 | CA9 (0.50) | CA9CA12CHRNA7CA1CA2 | |
| SCHEMBL8181215 | 0.90 | CA12 (0.48) | CA9CA12PTGS2MAPK13MAPK12 | |
| SCHEMBL8176091 | 0.90 | CA12 (0.48) | CA9CA12PTGS2MAPK13MAPK12 | |
| SCHEMBL8181108 | 0.88 | CA12 (0.47) | CA9CA12CA1CA2PTGS1 | |
| SCHEMBL7799176 | 0.88 | CA12 (0.47) | CA9CA12CA1CA2PTGS1 | |
| SCHEMBL8174257 | 0.87 | ALDH1A1 (0.47) | CA9CA12CA1CA2CA4 | |
| SCHEMBL8181992 | 0.87 | ALDH1A1 (0.47) | CA9CA12CA1CA2CA4 | |
| SCHEMBL8174276 | 0.85 | TP53 (0.46) | CA9CA12CA1CA2PTGS1 | |
| SCHEMBL8175722 | 0.85 | TP53 (0.46) | CA9CA12CA1CA2PTGS1 | |
| SCHEMBL7779780 | 0.84 | IKBKB (0.46) | CA9CA12CA1CA2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0772597-B1 | 3,4-SUBSTITUTED PYRAZOLES FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 2001-12-12 | — | — | EP | claimed |
| US-6028072-A | 3,4-substituted pyrazoles for the treatment of inflammation | G. D. SEARLE & CO. (US) | 2000-02-22 | — | — | US | claimed |