Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 19/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 17/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2995422 | 1.00 | CHRM3 (0.51) | CHRM3CHRM2CHRM1CHRNB4CHRNA3 | |
| SCHEMBL13240902 | 0.92 | CHRM3 (0.55) | CHRM3CHRM2CHRM1CHRNB4CHRNA3 | |
| SCHEMBL16649371 | 0.92 | CHRM3 (0.55) | CHRM3CHRM2CHRM1CHRNB4CHRNA3 | |
| Trifluoroacetic Acid SCHEMBL2992250 | 0.91 | CHRM2 (0.52) | CHRM3CHRM2CHRM1 | |
| Trifluoroacetic Acid SCHEMBL2484663 | 0.91 | CHRM2 (0.52) | CHRM3CHRM2CHRM1 | |
| Trifluoroacetic Acid SCHEMBL2514327 | 0.88 | CHRM3 (0.41) | CHRM3CHRM2CHRM1 | |
| Trifluoroacetic Acid SCHEMBL2990557 | 0.88 | CHRM3 (0.43) | CHRM3CHRM2CHRM1 | |
| Trifluoroacetic Acid SCHEMBL14988076 | 0.88 | CHRM3 (0.41) | CHRM3CHRM2CHRM1 | |
| Trifluoroacetic Acid SCHEMBL2485962 | 0.88 | CHRM3 (0.41) | CHRM3CHRM2CHRM1 | |
| Trifluoroacetic Acid SCHEMBL2998297 | 0.88 | CHRM3 (0.39) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2376489-A1 | Alkaloid aminoester derivatives and medicinal composition thereof | Chiesi Farmaceutici S.p.A. (IT) | 2011-10-19 | — | — | EP | claimed |
| WO-2010072338-A1 | ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | CHIESI FARMACEUTICI S.P.A. (IT) | 2010-07-01 | — | — | WO | claimed |