Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 19/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | VDR | P11473 | 1/20 | 0.36 |
| ▸ | FABP1 | P07148 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14215785 | 0.92 | NR1H4 (0.60) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215912 | 0.88 | NR1H4 (0.51) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215809 | 0.85 | KDM4E (0.44) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215706 | 0.84 | NR1H4 (0.49) | NR1H4CYP1A2CYP2C9 | |
| SCHEMBL14215783 | 0.84 | NR1H4 (0.50) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215908 | 0.83 | NR1H4 (0.60) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215810 | 0.82 | NR1H4 (0.49) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL13999631 | 0.82 | NR1H4 (0.40) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215784 | 0.81 | NR1H4 (0.46) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 | |
| SCHEMBL14215704 | 0.80 | NR1H4 (0.60) | NR1H4CYP1A2CYP2C9NR1I2CYP3A4 |
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-2008051942-A2 | FARNESOID X RECEPTOR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-05-02 | — | — | WO | disclosed |