Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | MMP14 | P50281 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5236497 | 0.90 | ALOX5 (0.41) | ALOX5MMP13MMP14MAPK14ALDH1A1 | |
| SCHEMBL5238294 | 0.90 | ALOX5 (0.41) | ALOX5MMP13MMP14MAPK14ALDH1A1 | |
| SCHEMBL5233481 | 0.89 | ALDH1A1 (0.30) | ALOX5ALDH1A1 | |
| SCHEMBL5236015 | 0.86 | KDM4E (0.43) | ALDH1A1 | |
| SCHEMBL5236069 | 0.85 | ALOX5 (0.38) | ALOX5MMP13MMP14MAPK14ALDH1A1 | |
| SCHEMBL5236077 | 0.85 | ALOX5 (0.38) | ALOX5MMP13MMP14MAPK14ALDH1A1 | |
| SCHEMBL5236387 | 0.85 | KDM4E (0.39) | ALDH1A1 | |
| SCHEMBL5234129 | 0.83 | ADORA3 (0.37) | ALDH1A1 | |
| SCHEMBL5236797 | 0.83 | — | — | |
| SCHEMBL5236283 | 0.83 | — | — |
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-1730116-B1 | 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORP (US) | 2007-09-05 | — | — | EP | claimed |