Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 20/20 | 0.54 |
| ▸ | LIFR | P42702 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3635363 | 0.93 | NR1H4 (0.59) | NR1H4LIFR | |
| SCHEMBL2811507 | 0.88 | NR1H4 (0.72) | NR1H4LIFRNR1I2CYP1A2CYP3A4 | |
| SCHEMBL4950471 | 0.83 | NR1H4 (0.66) | NR1H4LIFRNR1I2CYP1A2CYP3A4 | |
| SCHEMBL4946708 | 0.82 | NR1H4 (0.64) | NR1H4LIFRNR1I2CYP1A2CYP3A4 | |
| SCHEMBL3643842 | 0.81 | NR1H4 (0.66) | NR1H4NR1I2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3642778 | 0.81 | NR1H4 (0.67) | NR1H4LIFRCYP1A2CYP2C9 | |
| SCHEMBL2810006 | 0.81 | NR1H4 (0.76) | NR1H4LIFRNR1I2CYP1A2CYP3A4 | |
| SCHEMBL3639762 | 0.80 | NR1H4 (0.78) | NR1H4LIFR | |
| SCHEMBL3635353 | 0.80 | NR1H4 (0.67) | NR1H4LIFRCYP1A2CYP2C9 | |
| SCHEMBL3642254 | 0.79 | NR1H4 (0.55) | NR1H4LIFRCYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2170072-A1 | FARNESOID X RECEPTOR AGONISTS | GlaxoSmithKline LLC (US) | 2010-04-07 | — | — | EP | disclosed |
| WO-2008157270-A1 | FARNESOID X RECEPTOR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-24 | — | — | WO | disclosed |