Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.60 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.60 |
| ▸ | NR1H4 | Q96RI1 | 5/20 | 0.59 |
| ▸ | PPARD | Q03181 | 3/20 | 0.59 |
| ▸ | PPARG | P37231 | 2/20 | 0.59 |
| ▸ | PPARA | Q07869 | 2/20 | 0.59 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.58 |
| ▸ | FADS1 | O60427 | 3/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HSPH1 | Q92598 | 1/20 | 0.50 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5718041 | 0.85 | ALOX15 (0.72) | ITGB3ITGA2BNR1H4PPARDPPARG | |
| SCHEMBL14018734 | 0.85 | FADS1 (0.60) | FADS1PTGS1ALOX15P2RX1ALDH1A1 | |
| SCHEMBL27541341 | 0.85 | PTGS1 (0.56) | ITGB3ITGA2BNR1H4FADS1PTGS1 | |
| SCHEMBL7450542 | 0.85 | ITGB3 (0.72) | ITGB3ITGA2BNR1H4PPARDPPARG | |
| SCHEMBL27484183 | 0.83 | FADS1 (0.60) | FADS1PTGS1P2RX1ALDH1A1 | |
| SCHEMBL20839943 | 0.83 | FADS1 (0.52) | NR1H4PPARGPPARAFADS1PTGS1 | |
| SCHEMBL17744881 | 0.81 | FADS1 (0.72) | FADS1PTGS1P2RX1ALDH1A1 | |
| SCHEMBL20852275 | 0.81 | NR1H4 (0.71) | ITGB3ITGA2BNR1H4PPARDPPARG | |
| SCHEMBL12264961 | 0.80 | FADS1 (0.60) | FADS1PTGS1P2RX1ALDH1A1 | |
| SCHEMBL1140055 | 0.78 | PTGS1 (0.68) | FADS1PTGS1P2RX1ALDH1A1 |
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 |