Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 12/20 | 0.55 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | BCL2 | P10415 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2813670 | 0.91 | NR1H4 (0.57) | NR1H4MRGPRX4 | |
| SCHEMBL2773667 | 0.88 | NR1H4 (0.56) | NR1H4NPBWR1MCHR1MRGPRX4 | |
| SCHEMBL2772411 | 0.88 | NR1H4 (0.61) | NR1H4MRGPRX4 | |
| SCHEMBL2772071 | 0.88 | NR1H4 (0.56) | NR1H4MRGPRX4 | |
| SCHEMBL2770526 | 0.87 | NR1H4 (0.57) | NR1H4NPBWR1MCHR1MRGPRX4 | |
| SCHEMBL2771757 | 0.87 | NR1H4 (0.65) | NR1H4MRGPRX4 | |
| SCHEMBL2770222 | 0.83 | NR1H4 (0.56) | NR1H4NPBWR1MCHR1MRGPRX4 | |
| SCHEMBL2771111 | 0.82 | NR1H4 (0.58) | NR1H4NPBWR1MCHR1MRGPRX4 | |
| SCHEMBL2787707 | 0.82 | NR1H4 (0.59) | NR1H4MRGPRX4 | |
| SCHEMBL2773796 | 0.80 | NR1H4 (0.62) | NR1H4MRGPRX4 |
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 |