Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 7/20 | 0.51 |
| ▸ | PPARG | P37231 | 4/20 | 0.51 |
| ▸ | PPARA | Q07869 | 4/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.51 |
| ▸ | PPARD | Q03181 | 6/20 | 0.49 |
| ▸ | BRAF | P15056 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839492 | 0.87 | NR1H4 (0.64) | CYP3A4CYP2C8CYP2C19CYP2C9NR1H4 | |
| SCHEMBL20839988 | 0.81 | NR1H4 (0.67) | NR1H4PPARGPPARAPPARD | |
| SCHEMBL20839936 | 0.79 | NR1H4 (0.65) | NR1H4PPARGPPARAPPARD | |
| SCHEMBL20839675 | 0.79 | NR1H4 (0.81) | NR1H4PPARGPPARAABCG2PPARD | |
| SCHEMBL20840618 | 0.79 | NR1H4 (0.59) | NR1H4PPARGPPARAPPARD | |
| SCHEMBL20839596 | 0.78 | NR1H4 (0.57) | NR1H4PPARGPPARAABCG2PPARD | |
| SCHEMBL20839618 | 0.78 | NR1H4 (0.53) | NR1H4PPARGPPARAABCG2PPARD | |
| SCHEMBL20839731 | 0.78 | NR1H4 (0.80) | NR1H4PPARGPPARAPPARD | |
| SCHEMBL20839717 | 0.78 | NR1H4 (0.70) | NR1H4PPARGPPARAABCG2PPARD | |
| SCHEMBL20839943 | 0.75 | FADS1 (0.52) | NR1H4PPARGPPARAABCG2HDAC1 |
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 |