Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 3/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CASR | P41180 | 2/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6204293 | 0.84 | L3MBTL1 (0.50) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL15271036 | 0.83 | CASR (0.51) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL7681682 | 0.83 | AOC3 (0.50) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL1742768 | 0.83 | AOC3 (0.50) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL6204864 | 0.82 | L3MBTL1 (0.51) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL4431450 | 0.82 | CASR (0.50) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL6204296 | 0.80 | AOC3 (0.56) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL11563492 | 0.80 | AOC3 (0.50) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL28759072 | 0.80 | ACHE (0.52) | AOC3ACHEL3MBTL1ALDH1A1CA1 | |
| SCHEMBL6204866 | 0.80 | AOC3 (0.56) | AOC3ACHEL3MBTL1ALDH1A1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109069514-A | Antimicrobial compound and application thereof | 结核病药物开发全球联盟公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-104812762-B | Substituted cyclic pyrimidin and triazine and their purposes | 拜耳药业股份公司 | 2018-01-16 | — | — | CN | disclosed |