Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29547077 | 1.00 | AOC3 (0.40) | AOC3CYP3A4ABCG2 | |
| SCHEMBL12175561 | 0.74 | NQO2 (0.34) | ABCG2 | |
| SCHEMBL30389041 | 0.69 | LMNA (0.40) | AOC3 | |
| SCHEMBL14363137 | 0.68 | SELL (0.41) | AOC3CYP3A4 | |
| SCHEMBL118556 | 0.67 | ABCG2 (0.50) | AOC3CYP3A4ABCG2 | |
| SCHEMBL5462155 | 0.65 | AOC3 (0.36) | AOC3CYP3A4ABCG2 | |
| SCHEMBL25166284 | 0.64 | CYP3A4 (0.38) | AOC3CYP3A4ABCG2 | |
| SCHEMBL30329818 | 0.64 | CYP3A4 (0.38) | AOC3CYP3A4ABCG2 | |
| SCHEMBL31637474 | 0.64 | MAOA (0.33) | — | |
| SCHEMBL2265157 | 0.63 | AOC3 (0.44) | AOC3CYP3A4ABCG2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005066181-A1 | PROCESS FOR THE PREPARATION OF 1,3-DIOXOLO [4,5-C] PIPERIDIN-7-OLS AND RELATED COMPOUNDS | DELMAR CHEMICALS INC. (CA) | 2005-07-21 | — | — | WO | disclosed |
| WO-2005018531-A2 | PHARMACEUTICAL COMPOSITIONS, AZO-HETEROCYCLIC COMPOUNDS AND METHOD FOR THE PRODUCTION AND USE THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE', LTD. (RU) | 2005-03-03 | — | — | WO | disclosed |