Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 13/20 | 0.68 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | THPO | P40225 | 1/20 | 0.62 |
| ▸ | BLM | P54132 | 1/20 | 0.62 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL5151993 | 0.91 | PTGS2 (0.70) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5148567 | 0.90 | PTGS2 (0.68) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5148824 | 0.89 | PTGS2 (0.67) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5149149 | 0.87 | PTGS2 (0.64) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL5150839 | 0.87 | PTGS2 (0.64) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5148913 | 0.84 | PTGS2 (0.60) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL14504548 | 0.83 | PTGS2 (0.67) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL14504542 | 0.83 | PTGS2 (0.67) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5147848 | 0.83 | PTGS2 (0.73) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 | |
| SCHEMBL5148972 | 0.83 | PTGS2 (0.73) | PTGS2PTGS1CYP2C9CYP1A2CYP3A4 |
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-1567503-A1 | PYRAZOLE DERIVATIVES USEFUL AS COX-I INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004050632-A1 | PYRAZOLE DERIVATIVES USEFUL AS COX-I INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-06-17 | — | — | WO | disclosed |