Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 20/20 | 0.87 |
| ▸ | HSD17B13 | Q7Z5P4 | 1/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL17843243 | 0.96 | NR1H4 (0.89) | NR1H4HSD17B13 | |
| SCHEMBL20032607 | 0.95 | NR1H4 (0.79) | NR1H4HSD17B13 | |
| SCHEMBL20749519 | 0.93 | NR1H4 (0.75) | NR1H4HSD17B13 | |
| SCHEMBL19690316 | 0.93 | NR1H4 (1.00) | NR1H4HSD17B13 | |
| SCHEMBL29383988 | 0.93 | NR1H4 (1.00) | NR1H4HSD17B13 | |
| SCHEMBL20032606 | 0.91 | NR1H4 (0.81) | NR1H4HSD17B13 | |
| SCHEMBL17858834 | 0.91 | NR1H4 (0.76) | NR1H4HSD17B13 | |
| SCHEMBL17843231 | 0.90 | NR1H4 (0.87) | NR1H4HSD17B13 | |
| SCHEMBL19472565 | 0.88 | NR1H4 (0.70) | NR1H4HSD17B13 | |
| SCHEMBL19699364 | 0.88 | NR1H4 (0.91) | NR1H4HSD17B13 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107108595-B | Novel FXR (NR1H4) modulating compounds | 吉利德科学公司 | 2021-04-06 | — | — | CN | disclosed |
| EP-3233831-B1 | NOVEL FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES INC (US) | 2019-02-20 | — | — | EP | disclosed |
| EP-3233831-B1 | NOVEL FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES INC (US) | 2019-02-20 | — | — | EP | disclosed |
| US-9938278-B2 | FXR (NR1H4) modulating compounds | GILEAD SCIENCES, INC. (US) | 2018-04-10 | — | — | US | disclosed |
| WO-2016096116-A1 | NOVEL FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2016-06-23 | — | — | WO | disclosed |