Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 8/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SPR | P35270 | 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 | |
|---|---|---|---|---|
| SCHEMBL1458472 | 0.75 | HTT (0.52) | ALDH1A1PDE10AHTT | |
| SCHEMBL16211920 | 0.74 | PDE10A (0.50) | ALDH1A1PDE10AHTTSPR | |
| SCHEMBL11890121 | 0.74 | PDE10A (0.51) | PDE10AHTT | |
| SCHEMBL15767454 | 0.72 | GAA (0.43) | ALDH1A1PDE10AHSD17B10HTTSPR | |
| SCHEMBL9926277 | 0.71 | PDE10A (0.49) | ALDH1A1PDE10AHTT | |
| SCHEMBL4594288 | 0.69 | CYP3A4 (0.46) | CYP3A4ALDH1A1HTT | |
| SCHEMBL7514360 | 0.68 | SMN1; SMN2 (0.50) | ALDH1A1PDE10AATML3MBTL1 | |
| SCHEMBL14368301 | 0.66 | EPHX2 (0.59) | ALDH1A1POLBHTTL3MBTL1 | |
| SCHEMBL9104445 | 0.65 | SMN1; SMN2 (0.53) | ALDH1A1PDE10APOLBHTTL3MBTL1 | |
| SCHEMBL27228782 | 0.65 | KDM4E (0.62) | ALDH1A1HTTATML3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105164126-B | The Pd catalytic couplings of pyrazole amide | 豪夫迈·罗氏有限公司 | 2017-05-31 | — | — | CN | disclosed |