Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.51 |
| ▸ | MRGPRX4 | Q96LA9 | 11/20 | 0.46 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2773169 | 0.93 | NR1H4 (0.48) | NR1H4MRGPRX4PPARATRPM8CYP26A1 | |
| SCHEMBL2771180 | 0.91 | NR1H4 (0.63) | NR1H4MRGPRX4TP53PKMNFKB1 | |
| SCHEMBL2772324 | 0.86 | NR1H4 (0.45) | NR1H4MRGPRX4PPARACYP26A1CYP3A4 | |
| SCHEMBL2771437 | 0.85 | NR1H4 (0.58) | NR1H4MRGPRX4PPARAPPARG | |
| SCHEMBL2769706 | 0.84 | NR1H4 (0.50) | NR1H4MRGPRX4PPARATP53PKM | |
| SCHEMBL2770975 | 0.84 | NR1H4 (0.44) | NR1H4MRGPRX4PPARATRPM8CYP26A1 | |
| SCHEMBL2773225 | 0.84 | NR1H4 (0.57) | NR1H4MRGPRX4PPARA | |
| SCHEMBL2773887 | 0.84 | NR1H4 (0.61) | NR1H4MRGPRX4CYP26A1CYP3A4 | |
| SCHEMBL2770354 | 0.84 | NR1H4 (0.43) | NR1H4MRGPRX4PPARATRPM8TP53 | |
| SCHEMBL2773707 | 0.83 | NR1H4 (0.60) | NR1H4MRGPRX4TRPM8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2029547-B1 | FXR AGONISTS | LILLY CO ELI (US) | 2010-04-28 | — | — | EP | disclosed |