Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 14/20 | 0.64 |
| ▸ | PTGS1 | P23219 | 8/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8765099 | 0.96 | PTGS2 (0.59) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8654487 | 0.94 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL8766098 | 0.94 | CYP1A2 (0.55) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8765208 | 0.89 | PTGS2 (0.60) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8766070 | 0.89 | PTGS2 (0.60) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8765162 | 0.89 | PTGS2 (0.62) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8765204 | 0.89 | PTGS2 (0.54) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8766197 | 0.88 | PTGS2 (0.52) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8764563 | 0.88 | PTGS2 (0.55) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 | |
| SCHEMBL8765186 | 0.88 | CYP1A2 (0.50) | PTGS2PTGS1CYP1A2CYP2D6GRIA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0731794-B1 | 1,4,5-TRIPHENYL PYRAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION AND INFLAMMATION-RELATED DISORDERS | SEARLE & CO (US) | 1997-08-06 | — | — | EP | disclosed |
| US-5639777-A | 1,4,5-triphenyl pyrazolyl compounds for the treatment of inflammation and inflammation-related disorders | G.D. SEARLE & CO. (US) | 1997-06-17 | — | — | US | disclosed |
| US-5401765-A | FOR TREATING ARTHRITIS, PAIN AND FEVER | Searle, G. D. (US) | 1995-03-28 | — | — | US | disclosed |