Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 4/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.44 |
| ▸ | PTGIR | P43119 | 9/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6317472 | 1.00 | SIRT1 (0.44) | SIRT1SIRT2PTGIRNR1H4PTGDR | |
| SCHEMBL14265716 | 0.95 | NR1H4 (0.45) | SIRT1SIRT2PTGIRNR1H4 | |
| SCHEMBL6797764 | 0.92 | SIRT1 (0.44) | SIRT1SIRT2PTGIRNR1H4 | |
| SCHEMBL6797758 | 0.92 | SIRT1 (0.44) | SIRT1SIRT2PTGIRNR1H4 | |
| SCHEMBL6797753 | 0.92 | SIRT1 (0.44) | SIRT1SIRT2PTGIRNR1H4 | |
| SCHEMBL6316987 | 0.87 | PTGIR (0.49) | PTGIRPTGDR | |
| SCHEMBL14286251 | 0.87 | SIRT1 (0.43) | SIRT1SIRT2PTGIRNR1H4 | |
| SCHEMBL6316993 | 0.87 | PTGIR (0.49) | PTGIRPTGDR | |
| SCHEMBL14265713 | 0.81 | PTGIR (0.50) | PTGIRPTGDR | |
| SCHEMBL5107428 | 0.80 | SIRT1 (0.48) | SIRT1SIRT2PTGIR |
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 |
|---|---|---|---|---|---|---|---|
| US-6846824-B2 | Bicyclic compounds and their use in medicine; process for their preparation and pharmaceutical compositions containing them | DR. REDDY'S LABORATORIES LTD. (IN) | 2005-01-25 | — | — | US | disclosed |