Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 18/20 | 0.67 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | VDR | P11473 | 2/20 | 0.43 |
| ▸ | LIFR | P42702 | 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 | |
|---|---|---|---|---|
| SCHEMBL2771697 | 0.93 | NR1H4 (0.63) | NR1H4MRGPRX4VDR | |
| SCHEMBL2772894 | 0.92 | NR1H4 (0.67) | NR1H4MRGPRX4LIFR | |
| SCHEMBL2770352 | 0.91 | NR1H4 (0.61) | NR1H4MRGPRX4VDRLIFR | |
| SCHEMBL2770454 | 0.89 | NR1H4 (0.59) | NR1H4MRGPRX4VDR | |
| SCHEMBL2771465 | 0.89 | NR1H4 (0.64) | NR1H4MRGPRX4LIFR | |
| SCHEMBL2773272 | 0.88 | NR1H4 (0.57) | NR1H4 | |
| SCHEMBL2770317 | 0.88 | NR1H4 (0.68) | NR1H4MRGPRX4LIFR | |
| SCHEMBL2773796 | 0.87 | NR1H4 (0.62) | NR1H4MRGPRX4LIFR | |
| SCHEMBL2774467 | 0.86 | NR1H4 (0.57) | NR1H4 | |
| SCHEMBL2771248 | 0.86 | NR1H4 (0.66) | NR1H4MRGPRX4LIFR |
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 |