Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MITF | O75030 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28937357 | 0.80 | THRB (0.84) | THRBTDP1ALDH1A1HTTAPEX1 | |
| SCHEMBL30488775 | 0.80 | THRB (1.00) | THRBTDP1ALDH1A1HTTL3MBTL1 | |
| SCHEMBL11469925 | 0.80 | THRB (1.00) | THRBTDP1ALDH1A1HTTL3MBTL1 | |
| SCHEMBL66735 | 0.80 | THRB (1.00) | THRBTDP1ALDH1A1HTTL3MBTL1 | |
| Bromide SCHEMBL27743796 | 0.78 | THRB (0.95) | THRBTDP1ALDH1A1HTTL3MBTL1 | |
| Dimethylamine SCHEMBL10338435 | 0.77 | THRB (0.84) | THRBTDP1ALDH1A1HTTSMN1; SMN2 | |
| Methyl Alcohol SCHEMBL21134117 | 0.76 | THRB (0.91) | THRBTDP1ALDH1A1HTTSMN1; SMN2 | |
| Bromomethane SCHEMBL208217 | 0.75 | THRB (0.88) | THRBTDP1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL11573153 | 0.74 | THRB (0.45) | THRBTDP1ALDH1A1HTTL3MBTL1 | |
| SCHEMBL4023112 | 0.73 | THRB (0.59) | THRBTDP1ALDH1A1HTTSMN1; SMN2 |
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-2009098453-A1 | AZONIA BICYCLOALKANES AS M3 MUSCARINIC ACETYLCHOLIN RECEPTOR ANTAGONISTS | ASTRAZENECA AB (SE) | 2009-08-13 | — | — | WO | disclosed |