Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL602826 | 0.95 | GPBAR1 (0.58) | GPBAR1NR1H4 | |
| SCHEMBL603734 | 0.93 | GPBAR1 (0.57) | GPBAR1NR1H4 | |
| SCHEMBL606246 | 0.90 | GPBAR1 (0.62) | GPBAR1NR1H4 | |
| SCHEMBL604601 | 0.90 | GPBAR1 (0.52) | GPBAR1NR1H4 | |
| SCHEMBL601745 | 0.89 | GPBAR1 (0.62) | GPBAR1NR1H4 | |
| SCHEMBL605382 | 0.88 | GPBAR1 (0.61) | GPBAR1NR1H4 | |
| SCHEMBL604597 | 0.87 | GPBAR1 (0.61) | GPBAR1NR1H4 | |
| SCHEMBL601798 | 0.86 | GPBAR1 (0.62) | GPBAR1NR1H4 | |
| Trifluoroacetic Acid SCHEMBL604726 | 0.85 | GPBAR1 (0.57) | GPBAR1NR1H4 | |
| SCHEMBL602479 | 0.84 | GPBAR1 (0.61) | GPBAR1NR1H4 |
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 |