Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 20/20 | 1.00 |
| ▸ | LIFR | P42702 | 2/20 | 0.72 |
| ▸ | PPARD | Q03181 | 2/20 | 0.72 |
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 | |
|---|---|---|---|---|
| SCHEMBL28512839 | 0.96 | NR1H4 (1.00) | NR1H4LIFRPPARD | |
| SCHEMBL28530295 | 0.92 | NR1H4 (1.00) | NR1H4LIFRPPARD | |
| SCHEMBL24425720 | 0.89 | NR1H4 (0.89) | NR1H4LIFRPPARD | |
| SCHEMBL28530665 | 0.87 | NR1H4 (1.00) | NR1H4LIFRPPARD | |
| SCHEMBL28518144 | 0.86 | NR1H4 (1.00) | NR1H4LIFRPPARD | |
| SCHEMBL21636777 | 0.85 | NR1H4 (1.00) | NR1H4LIFRPPARD | |
| SCHEMBL24425714 | 0.84 | NR1H4 (0.76) | NR1H4LIFRPPARD | |
| SCHEMBL21636802 | 0.84 | NR1H4 (0.76) | NR1H4LIFRPPARD | |
| SCHEMBL24425702 | 0.84 | NR1H4 (0.76) | NR1H4LIFRPPARD | |
| SCHEMBL4836990 | 0.84 | NR1H4 (0.72) | NR1H4LIFRPPARD |
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 |
|---|---|---|---|---|---|---|---|
| CN-112424173-A | Isoxazoles as FXR receptor agonists | 巴尔制药有限公司 | 2021-02-26 | — | — | CN | disclosed |