Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 8/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5794544 | 0.84 | ACHE (0.46) | ACHEMAOAMAOB | |
| SCHEMBL15047785 | 0.78 | MAOA (0.62) | ACHEMAOAMAOB | |
| SCHEMBL8276695 | 0.70 | MAOA (0.62) | ACHEMAOAMAOB | |
| SCHEMBL6267123 | 0.68 | ACHE (0.43) | ACHEMAOAMAOBDRD2 | |
| SCHEMBL16270263 | 0.67 | MAOA (0.64) | ACHEMAOAMAOB | |
| SCHEMBL3300396 | 0.67 | ACHE (0.49) | ACHEMAOAMAOB | |
| SCHEMBL3299930 | 0.67 | ACHE (0.49) | ACHEMAOAMAOB | |
| SCHEMBL5899449 | 0.66 | ACHE (0.48) | ACHEMAOAMAOB | |
| SCHEMBL784422 | 0.65 | HTR2A (0.41) | ACHE | |
| SCHEMBL6330769 | 0.65 | ACHE (0.41) | ACHEMAOAMAOBDRD2 |
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-2006014968-A2 | PROPARGYL NITROXYDES AND INDANYL NITROXIDES AND THEIR USE FOR THE TREATMENT OF NEUROLOGIC DISEASES AND DISORDERS | TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) | 2006-02-09 | — | — | WO | disclosed |