Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.68 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.68 |
| ▸ | CCKAR | P32238 | 9/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | THPO | P40225 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | RXRA | P19793 | 1/20 | 0.59 |
| ▸ | RXRB | P28702 | 1/20 | 0.59 |
| ▸ | RXRG | P48443 | 1/20 | 0.59 |
| ▸ | MALT1 | Q9UDY8 | 4/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9519044 | 0.93 | PTGS2 (0.66) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9519309 | 0.86 | PTGS2 (0.63) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9297089 | 0.86 | PTGS2 (0.65) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9520376 | 0.86 | PTGS2 (0.66) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL5387633 | 0.86 | PTGS2 (0.69) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9521167 | 0.85 | PTGS2 (0.77) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9349968 | 0.85 | PTGS2 (0.64) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9081722 | 0.85 | CA1 (0.69) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9519599 | 0.85 | PTGS2 (0.67) | PTGS2ALOX5CCKARPTGS1CYP1A2 | |
| SCHEMBL9519742 | 0.85 | PTGS2 (0.64) | PTGS2ALOX5CCKARPTGS1CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0248594-B1 | Pharmacologically active 1,5-diaryl-3-substituted-pyrazoles and method for synthesizing the same | ORTHO PHARMA CORP (US) | 1993-11-24 | — | — | EP | disclosed |
| US-5164381-A | Cardiovascular, antiinflammatory | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-11-17 | — | — | US | disclosed |
| US-4826868-A | 1,5-Diaryl-3-substituted pyrazoles pharmaceutical compositions and use | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-05-02 | — | — | US | disclosed |
| EP-0248594-A2 | Pharmacologically active 1,5-diaryl-3-substituted-pyrazoles and method for synthesizing the same | ORTHO PHARMACEUTICAL CORPORATION (US) | 1987-12-09 | — | — | EP | disclosed |