Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.77 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.77 |
| ▸ | RXRA | P19793 | 2/20 | 0.69 |
| ▸ | RXRB | P28702 | 2/20 | 0.69 |
| ▸ | RXRG | P48443 | 2/20 | 0.69 |
| ▸ | CCKAR | P32238 | 9/20 | 0.64 |
| ▸ | MALT1 | Q9UDY8 | 3/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | THPO | P40225 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL5393447 | 0.90 | RXRA (0.84) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9519465 | 0.90 | PTGS2 (0.79) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9522066 | 0.89 | PTGS2 (0.77) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9520164 | 0.88 | PTGS2 (0.76) | PTGS2ALOX5RXRARXRBRXRG | |
| Tepoxalin SCHEMBL75441 | 0.87 | PTGS2 (1.00) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9521172 | 0.87 | PTGS2 (0.68) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9519230 | 0.87 | PTGS2 (0.74) | PTGS2ALOX5RXRARXRBRXRG | |
| Water SCHEMBL10551403 | 0.87 | PTGS2 (0.74) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL5382607 | 0.86 | PTGS2 (0.76) | PTGS2ALOX5RXRARXRBRXRG | |
| Tepoxalin SCHEMBL9519652 | 0.86 | PTGS2 (0.98) | PTGS2ALOX5RXRARXRBRXRG |
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-0248594-B1 | Pharmacologically active 1,5-diaryl-3-substituted-pyrazoles and method for synthesizing the same | ORTHO PHARMA CORP (US) | 1993-11-24 | — | — | EP | claimed |
| 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 | claimed |