Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 8/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13259966 | 0.84 | GPBAR1 (0.59) | GPBAR1MAPTHTTHSD11B1ALDH1A1 | |
| SCHEMBL10229734 | 0.82 | GPBAR1 (0.64) | GPBAR1KMT2AALDH1A1 | |
| SCHEMBL13259018 | 0.79 | GPBAR1 (0.67) | GPBAR1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL13259961 | 0.76 | GPBAR1 (0.47) | GPBAR1KMT2AMAPTHTTHSD11B1 | |
| SCHEMBL13259977 | 0.72 | GPBAR1 (0.47) | GPBAR1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL13259058 | 0.69 | GPBAR1 (0.52) | GPBAR1ALDH1A1 | |
| SCHEMBL13259015 | 0.68 | GPBAR1 (0.46) | GPBAR1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL13259019 | 0.67 | GPBAR1 (0.47) | GPBAR1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL13259965 | 0.67 | GPBAR1 (0.54) | GPBAR1ALDH1A1 | |
| SCHEMBL10229657 | 0.67 | GPBAR1 (0.66) | GPBAR1KMT2AMAPTHTTHSD11B1 |
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-2010093845-A1 | TRIAZOLE AND IMIDAZOLE DERIVATIVES FOR USE AS TGR5 AGONISTS IN THE TREATMENT OF DIABETES AND OBESITY | EXELIXIS, INC. (US) | 2010-08-19 | — | — | WO | disclosed |