Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 11/20 | 0.72 |
| ▸ | PPARD | Q03181 | 10/20 | 0.72 |
| ▸ | PPARG | P37231 | 8/20 | 0.72 |
| ▸ | PPARA | Q07869 | 8/20 | 0.72 |
| ▸ | HSPH1 | Q92598 | 1/20 | 0.58 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.54 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.51 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.51 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP10 | P09238 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | MMP12 | P39900 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | MMP14 | P50281 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL20852079 | 0.89 | NR1H4 (0.81) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839629 | 0.87 | NR1H4 (0.56) | NR1H4PPARDPPARGPPARAHDAC1 | |
| SCHEMBL20852080 | 0.87 | NR1H4 (0.71) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839658 | 0.86 | NR1H4 (0.71) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839684 | 0.82 | NR1H4 (1.00) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839711 | 0.82 | NR1H4 (0.74) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839783 | 0.81 | NR1H4 (0.80) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839937 | 0.80 | NR1H4 (0.71) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20839503 | 0.80 | NR1H4 (0.68) | NR1H4PPARDPPARGPPARAHSPH1 | |
| SCHEMBL20852275 | 0.78 | NR1H4 (0.71) | 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 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 |