Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 10/20 | 0.61 |
| ▸ | PPARD | Q03181 | 9/20 | 0.61 |
| ▸ | PPARG | P37231 | 7/20 | 0.61 |
| ▸ | PPARA | Q07869 | 7/20 | 0.61 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.52 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | HSPH1 | Q92598 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.46 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839740 | 0.87 | NR1H4 (0.50) | NR1H4PPARDPPARGPPARAGFER | |
| SCHEMBL20852275 | 0.82 | NR1H4 (0.71) | NR1H4PPARDPPARGPPARASIRT1 | |
| SCHEMBL20852079 | 0.78 | NR1H4 (0.81) | NR1H4PPARDPPARGPPARASIRT1 | |
| SCHEMBL5718041 | 0.77 | ALOX15 (0.72) | NR1H4PPARDPPARGPPARASIRT1 | |
| SCHEMBL20839783 | 0.77 | NR1H4 (0.80) | NR1H4PPARDPPARGPPARAITGB3 | |
| SCHEMBL20839480 | 0.76 | ITGB3 (0.60) | NR1H4PPARDPPARGPPARASIRT1 | |
| SCHEMBL7450542 | 0.74 | ITGB3 (0.72) | NR1H4PPARDPPARGPPARASIRT1 | |
| SCHEMBL20839733 | 0.73 | NR1H4 (0.72) | NR1H4PPARDPPARGPPARAITGB3 | |
| SCHEMBL20839492 | 0.73 | NR1H4 (0.64) | NR1H4PPARDPPARGPPARAITGB3 | |
| SCHEMBL20839965 | 0.73 | NR1H4 (0.56) | NR1H4PPARDPPARGPPARASIRT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019057969-A1 | DUAL AGONISTS OF FXR AND PPARδ AND THEIR USES | Johann Wolfgang Goethe-Universität (DE) | 2019-03-28 | — | — | WO | disclosed |
| WO-2019057969-A1 | DUAL AGONISTS OF FXR AND PPARδ AND THEIR USES | Johann Wolfgang Goethe-Universität (DE) | 2019-03-28 | — | — | WO | disclosed |