Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.47 |
| ▸ | HTR3A | P46098 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 10/20 | 0.47 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.45 |
| ▸ | EP300 | Q09472 | 3/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.43 |
| ▸ | PBK | Q96KB5 | 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 | |
|---|---|---|---|---|
| SCHEMBL8251721 | 0.91 | CHRNA7 (0.47) | CHRNA7CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL4592240 | 0.78 | CHRNA7 (0.51) | CHRNA7HTR3AUTS2R | |
| SCHEMBL8258082 | 0.77 | HDAC3 (0.47) | CHRM1EP300SMYD3 | |
| SCHEMBL8251733 | 0.76 | ADAMTS4 (0.50) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL22373887 | 0.76 | ADAMTS4 (0.50) | CHRM1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL8260020 | 0.76 | PYGL (0.57) | SMYD3 | |
| SCHEMBL18264043 | 0.76 | CHRNA1 (0.59) | CHRNA7HTR3AUTS2RPBK | |
| SCHEMBL18264041 | 0.76 | CHRNA1 (0.59) | CHRNA7HTR3AUTS2RPBK | |
| SCHEMBL8255991 | 0.76 | SMYD3 (0.58) | CHRM1SMYD3 | |
| SCHEMBL22373838 | 0.76 | SCN9A (0.48) | CHRM1CHRM3CHRM2CHRM4CHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| US-7820699-B2 | Cyclic amines | HOFFMANN-LA ROCHE INC. (US) | 2010-10-26 | — | — | US | disclosed |
| US-7820699-B2 | Cyclic amines | HOFFMANN-LA ROCHE INC. (US) | 2010-10-26 | — | — | US | disclosed |
| WO-2006114401-A2 | NOVEL CYCLIC AMINES | F. HOFFMANN-LA ROCHE AG (CH) | 2006-11-02 | — | — | WO | disclosed |