Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.59 |
| ▸ | PPARG | P37231 | 1/20 | 0.59 |
| ▸ | PPARD | Q03181 | 1/20 | 0.59 |
| ▸ | PPARA | Q07869 | 1/20 | 0.59 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | PLAU | P00749 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839941 | 0.87 | NR1H4 (0.70) | NR1H4PPARGPPARDPPARARXFP1 | |
| SCHEMBL20839497 | 0.80 | RXFP1 (0.59) | NR1H4PPARGPPARDPPARARXFP1 | |
| SCHEMBL20839620 | 0.76 | ALDH1A1 (0.60) | RAB9AALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL20840618 | 0.76 | NR1H4 (0.59) | NR1H4PPARGPPARDPPARARXFP1 | |
| SCHEMBL20839988 | 0.76 | NR1H4 (0.67) | NR1H4PPARGPPARDPPARARXFP1 | |
| SCHEMBL7787088 | 0.74 | RAB9A (0.70) | NPC1RAB9APOLBCASP3SENP8 | |
| SCHEMBL7449026 | 0.74 | NR1H4 (0.72) | NR1H4PPARGPPARDPPARARXFP1 | |
| SCHEMBL20839638 | 0.74 | NR1H4 (0.73) | NR1H4PPARGPPARDPPARARXFP1 | |
| SCHEMBL1696931 | 0.74 | ALDH1A1 (0.64) | NPC1RAB9APOLBCASP3SENP8 | |
| SCHEMBL3059908 | 0.74 | SMN1; SMN2 (0.65) | PPARGPPARANPC1RAB9AALDH1A1 |
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 |