Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 10/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.34 |
| ▸ | SLC8A1 | P32418 | 8/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230827 | 0.85 | NR1H4 (0.37) | NR1H4MCL1SLC8A1 | |
| SCHEMBL19230560 | 0.83 | NR1H4 (0.37) | NR1H4SLC8A1 | |
| SCHEMBL19230633 | 0.83 | MRGPRX4 (0.38) | NR1H4SLC8A1 | |
| SCHEMBL19230696 | 0.82 | ITGB3 (0.39) | NR1H4SLC8A1 | |
| SCHEMBL19230537 | 0.82 | SLC8A1 (0.36) | SLC8A1 | |
| SCHEMBL19230374 | 0.79 | NR1H4 (0.33) | NR1H4SLC8A1 | |
| SCHEMBL19230683 | 0.79 | SLC8A1 (0.34) | SLC8A1 | |
| SCHEMBL19230657 | 0.78 | SLC8A1 (0.36) | SLC8A1 | |
| SCHEMBL19230544 | 0.78 | ITGB3 (0.35) | NR1H4SLC8A1 | |
| SCHEMBL19230377 | 0.78 | SLC8A1 (0.37) | NR1H4SLC8A1 |
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-2017133521-A1 | FXR RECEPTOR AGONIST | 山东轩竹医药科技有限公司 | 2017-08-10 | — | — | WO | disclosed |