Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.73 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.73 |
| ▸ | MALT1 | Q9UDY8 | 6/20 | 0.64 |
| ▸ | MARS1 | P56192 | 1/20 | 0.57 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.55 |
| ▸ | RPA1 | P27694 | 3/20 | 0.54 |
| ▸ | CCKAR | P32238 | 2/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.53 |
| ▸ | RELA | Q04206 | 2/20 | 0.53 |
| ▸ | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL9149353 | 0.91 | PTGS2 (0.60) | PTGS2ALOX5MALT1CHRNA7RPA1 | |
| SCHEMBL8475502 | 0.89 | MALT1 (0.68) | PTGS2ALOX5MALT1MARS1CHRNA7 | |
| Tepoxalin SCHEMBL75441 | 0.84 | PTGS2 (1.00) | PTGS2ALOX5MALT1CCKARPTGS1 | |
| Tepoxalin SCHEMBL9519652 | 0.84 | PTGS2 (0.98) | PTGS2ALOX5MALT1CCKARPTGS1 | |
| SCHEMBL9080028 | 0.82 | PTGS2 (0.81) | PTGS2ALOX5MALT1CCKARPTGS1 | |
| SCHEMBL9353410 | 0.81 | CHRNA7 (0.72) | PTGS2ALOX5MALT1MARS1CHRNA7 | |
| Tepoxalin SCHEMBL28256087 | 0.79 | ALOX5 (0.87) | PTGS2ALOX5MALT1CCKARPTGS1 | |
| SCHEMBL9349921 | 0.79 | PTGS2 (0.66) | PTGS2ALOX5MALT1MARS1CCKAR | |
| SCHEMBL9522439 | 0.78 | PTGS2 (0.79) | PTGS2ALOX5MALT1CCKARPTGS1 | |
| Water SCHEMBL9349800 | 0.78 | PTGS2 (0.65) | PTGS2ALOX5MALT1CCKARPTGS1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5117054-A | Chemical intermediate for antiinflammatory agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-05-26 | — | — | US | disclosed |