Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tepoxalin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 known ✓ | P35354 | 4/20 | 0.98 |
| ▸ | ALOX5 known ✓ | P09917 | 2/20 | 0.98 |
| ▸ | PTGS1 known ✓ | P23219 | 3/20 | 0.53 |
| ▸ | RXRA | P19793 | 2/20 | 0.65 |
| ▸ | RXRB | P28702 | 2/20 | 0.65 |
| ▸ | RXRG | P48443 | 2/20 | 0.65 |
| ▸ | CCKAR | P32238 | 10/20 | 0.63 |
| ▸ | MALT1 | Q9UDY8 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | THPO | P40225 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Tepoxalin SCHEMBL75441 | 0.99 | PTGS2 (1.00) | PTGS2ALOX5RXRARXRBRXRG | |
| Tepoxalin SCHEMBL28256087 | 0.93 | ALOX5 (0.87) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9519214 | 0.90 | ALOX5 (0.83) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9522599 | 0.90 | ALOX5 (0.83) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9520508 | 0.90 | ALOX5 (0.83) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9519177 | 0.89 | ALOX5 (0.82) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9697622 | 0.89 | PTGS2 (0.82) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9519478 | 0.89 | PTGS2 (0.81) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9519062 | 0.89 | PTGS2 (0.81) | PTGS2ALOX5RXRARXRBRXRG | |
| SCHEMBL9080028 | 0.89 | PTGS2 (0.81) | 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 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 |