Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 18/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 16/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 9/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13282721 | 1.00 | CHRM3 (0.42) | CHRM3CHRM2CHRM1NPSR1CYP2D6 | |
| SCHEMBL3782039 | 1.00 | CHRM3 (0.42) | CHRM3CHRM2CHRM1NPSR1CYP2D6 | |
| SCHEMBL3775856 | 1.00 | CHRM3 (0.42) | CHRM3CHRM2CHRM1NPSR1CYP2D6 | |
| Bromide SCHEMBL2542613 | 0.99 | CHRM3 (0.44) | CHRM3CHRM2CHRM1NPSR1 | |
| Bromide SCHEMBL2482100 | 0.99 | CHRM3 (0.44) | CHRM3CHRM2CHRM1NPSR1 | |
| Trifluoroacetic Acid SCHEMBL2482985 | 0.93 | CHRM3 (0.41) | CHRM3CHRM2CHRM1NPSR1 | |
| SCHEMBL3785004 | 0.88 | CHRM3 (0.47) | CHRM3CHRM2CHRM1 | |
| SCHEMBL13285508 | 0.88 | CHRM3 (0.47) | CHRM3CHRM2CHRM1 | |
| SCHEMBL3780154 | 0.88 | CHRM3 (0.47) | CHRM3CHRM2CHRM1 | |
| SCHEMBL3780152 | 0.88 | CHRM3 (0.47) | CHRM3CHRM2CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2376489-B1 | ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | CHIESI FARMA SPA (IT) | 2015-04-22 | — | — | EP | claimed |
| US-8835682-B2 | Alkaloid aminoester derivatives and medicinal composition thereof | CHIESI FARMACEUTICI S.P.A. (IT) | 2014-09-16 | — | — | US | disclosed |
| EP-2206712-A1 | \"Alkaloid aminoester derivatives and medicinal composition thereof\ | CHIESI FARMACEUTICI S.p.A. (IT) | 2010-07-14 | — | — | EP | disclosed |