Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 20/20 | 0.73 |
| ▸ | HSD17B13 | Q7Z5P4 | 1/20 | 0.67 |
| ▸ | FXR2 | P51116 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230761 | 0.92 | NR1H4 (0.62) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230625 | 0.92 | NR1H4 (0.74) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230541 | 0.92 | NR1H4 (0.74) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230515 | 0.92 | NR1H4 (0.74) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230566 | 0.91 | NR1H4 (0.71) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230535 | 0.90 | NR1H4 (0.67) | NR1H4 | |
| SCHEMBL19230557 | 0.90 | NR1H4 (0.71) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230626 | 0.88 | NR1H4 (0.70) | NR1H4HSD17B13FXR2 | |
| SCHEMBL19230559 | 0.88 | NR1H4 (0.69) | NR1H4HSD17B13FXR2 | |
| SCHEMBL18020277 | 0.86 | NR1H4 (0.92) | NR1H4HSD17B13FXR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108602811-B | FXR receptor agonists | 轩竹生物科技有限公司 | 2021-11-16 | — | — | CN | disclosed |
| WO-2017133521-A1 | FXR RECEPTOR AGONIST | 山东轩竹医药科技有限公司 | 2017-08-10 | — | — | WO | disclosed |