Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.60 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.60 |
| ▸ | CA1 | P00915 | 8/20 | 0.58 |
| ▸ | CA2 | P00918 | 8/20 | 0.58 |
| ▸ | ACHE | P22303 | 6/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6230657 | 0.90 | CA2 (0.71) | PTGS1PTGS2CA1CA2ACHE | |
| SCHEMBL5858805 | 0.90 | PTGS1 (0.60) | PTGS1PTGS2CA1CA2ACHE | |
| SCHEMBL5857642 | 0.87 | PTGS1 (0.63) | PTGS1PTGS2 | |
| Enflicoxib SCHEMBL26427 | 0.86 | PTGS1 (0.66) | PTGS1PTGS2CA1CA2ACHE | |
| SCHEMBL5857924 | 0.85 | PTGS1 (0.64) | PTGS1PTGS2CA2 | |
| SCHEMBL5858890 | 0.85 | PTGS1 (0.63) | PTGS1PTGS2 | |
| SCHEMBL5856299 | 0.84 | L3MBTL1 (0.71) | PTGS1PTGS2CA1CA2L3MBTL1 | |
| SCHEMBL5857443 | 0.84 | CA2 (0.64) | PTGS1PTGS2CA1CA2ACHE | |
| SCHEMBL5856805 | 0.82 | PTGS1 (0.74) | PTGS1PTGS2 | |
| SCHEMBL5856591 | 0.81 | PTGS1 (0.67) | PTGS1PTGS2 |
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-1083171-B1 | PYRAZOLINE DERIVATIVES, THEIR PREPARATION AND APPLICATION AS MEDICAMENTS | ESTEVE LABOR DR (ES) | 2004-04-28 | — | — | EP | claimed |