Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 9/20 | 0.70 |
| ▸ | PPARD | Q03181 | 4/20 | 0.67 |
| ▸ | PPARG | P37231 | 4/20 | 0.59 |
| ▸ | PPARA | Q07869 | 3/20 | 0.59 |
| ▸ | HSPH1 | Q92598 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.49 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.47 |
| ▸ | RXFP2 | Q8WXD0 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839783 | 0.85 | NR1H4 (0.80) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839645 | 0.84 | NR1H4 (0.73) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839624 | 0.83 | NR1H4 (0.78) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839500 | 0.83 | NR1H4 (1.00) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839737 | 0.82 | NR1H4 (0.80) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839667 | 0.82 | HSPH1 (0.73) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839781 | 0.82 | NR1H4 (0.71) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839977 | 0.82 | NR1H4 (0.77) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839666 | 0.81 | NR1H4 (0.86) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20852070 | 0.80 | NR1H4 (0.75) | NR1H4PPARDPPARGPPARAHSPH1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019057969-A1 | DUAL AGONISTS OF FXR AND PPARδ AND THEIR USES | Johann Wolfgang Goethe-Universität (DE) | 2019-03-28 | — | — | WO | disclosed |