Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 19/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | FXR2 | P51116 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20047710 | 0.91 | NR1H4 (0.63) | NR1H4CYP3A4CYP2C8 | |
| SCHEMBL20047746 | 0.89 | NR1H4 (0.66) | NR1H4CYP3A4CYP2C8 | |
| SCHEMBL20049237 | 0.89 | NR1H4 (0.49) | NR1H4CYP3A4CYP2C8FXR2 | |
| SCHEMBL20049504 | 0.83 | NR1H4 (0.61) | NR1H4FXR2 | |
| SCHEMBL20043486 | 0.83 | NR1H4 (0.64) | NR1H4FXR2 | |
| SCHEMBL20047728 | 0.82 | NR1H4 (0.62) | NR1H4CYP3A4CYP2C8FXR2 | |
| SCHEMBL20047709 | 0.80 | NR1H4 (0.52) | NR1H4CYP3A4CYP2C8FXR2 | |
| SCHEMBL20047726 | 0.80 | NR1H4 (0.61) | NR1H4CYP3A4CYP2C8FXR2 | |
| SCHEMBL20047745 | 0.79 | NR1H4 (0.81) | NR1H4CYP3A4CYP2C8 | |
| SCHEMBL20047727 | 0.79 | NR1H4 (0.52) | NR1H4CYP3A4CYP2C8FXR2 |
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-2018067704-A1 | ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2018-04-12 | — | — | WO | disclosed |