Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYSLTR2 | Q9NS75 | 5/20 | 0.31 |
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11712934 | 0.92 | PPARA (0.33) | NR1H2NR1H3CYP2D6PPARA | |
| SCHEMBL7798017 | 0.91 | LIPG (0.45) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL11110474 | 0.91 | LIPG (0.45) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL10351159 | 0.89 | LIPG (0.46) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL8923737 | 0.89 | LIPG (0.46) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL9477376 | 0.89 | LIPG (0.46) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL8920518 | 0.89 | LIPG (0.46) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL7766722 | 0.89 | LIPG (0.46) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL11182284 | 0.89 | LIPG (0.46) | NR1H2NR1H3LIPGCYSLTR2CYSLTR1 | |
| SCHEMBL10437918 | 0.87 | NR1H2 (0.37) | NR1H2NR1H3LIPGCYP3A4CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005037797-A1 | SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2005-04-28 | — | — | WO | claimed |
| US-20230220294-A1 | LUBRICANT COMPOSITION COMPRISING A 2,5-DIMERCAPTO-1,3,4-THIADIAZOLE ALKYL POLYCARBOXYLATE COMPOUND | TOTALENERGIES ONETECH (FR) | 2023-07-13 | — | — | US | disclosed |
| EP-0354871-B1 | Corrosion inhibition | CIBA GEIGY AG (CH) | 1993-11-24 | — | — | EP | disclosed |
| US-5176850-A | Corrosion Inhibitors | CIBA-GEIGY CORPORATION (US) | 1993-01-05 | — | — | US | disclosed |
| US-5013482-A | Ether acids | CIBA-GEIGY CORPORATION (US) | 1991-05-07 | — | — | US | disclosed |