Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 20/20 | 0.53 |
| ▸ | FABP1 | P07148 | 3/20 | 0.53 |
| ▸ | FABP4 | P15090 | 1/20 | 0.52 |
| ▸ | HSD17B13 | Q7Z5P4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL17839433 | 1.00 | NR1H4 (0.53) | NR1H4FABP1FABP4HSD17B13 | |
| SCHEMBL17839500 | 0.88 | NR1H4 (0.56) | NR1H4FABP1 | |
| SCHEMBL20859123 | 0.88 | NR1H4 (0.56) | NR1H4FABP1 | |
| SCHEMBL17839667 | 0.88 | NR1H4 (0.59) | NR1H4FABP1FABP4HSD17B13 | |
| SCHEMBL17856126 | 0.85 | NR1H4 (0.54) | NR1H4FABP1FABP4 | |
| SCHEMBL17839891 | 0.85 | NR1H4 (0.54) | NR1H4FABP1FABP4 | |
| SCHEMBL17839893 | 0.85 | NR1H4 (0.54) | NR1H4FABP1FABP4 | |
| SCHEMBL17856130 | 0.85 | NR1H4 (0.52) | NR1H4FABP1 | |
| SCHEMBL17839903 | 0.83 | NR1H4 (0.57) | NR1H4FABP1FABP4HSD17B13 | |
| SCHEMBL28588541 | 0.83 | NR1H4 (0.57) | NR1H4FABP1FABP4HSD17B13 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3233850-A1 | HYDROXY CONTAINING FXR (NR1H4) MODULATING COMPOUNDS | Gilead Sciences, Inc. (US) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016096115-A1 | HYDROXY CONTAINING FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2016-06-23 | — | — | WO | disclosed |