Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 2/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2762809 | 0.83 | CHRNA3 (0.67) | CHRNA3CHRNA7HTR3A | |
| SCHEMBL2763505 | 0.79 | CYP1A2 (0.52) | CYP1A2ADRA2AMAOASLC6A2HTR2C | |
| SCHEMBL4429334 | 0.78 | CHRNA3 (0.59) | CHRNA3CHRNA7HTR3A | |
| SCHEMBL2763504 | 0.76 | KMT2A (0.48) | CHRNA3CHRNA7HTR3AMAOA | |
| SCHEMBL6536307 | 0.70 | MAPT (0.58) | SRD5A2CYP1A2ADRA2AMAOASLC6A2 | |
| SCHEMBL2802761 | 0.69 | KCNH2 (0.59) | CHRNA3CHRNA7HTR3ASLC6A2SLC6A4 | |
| SCHEMBL2763026 | 0.68 | CHRNA3 (0.68) | CHRNA3CHRNA7HTR3A | |
| SCHEMBL5744226 | 0.67 | HTR2A (0.45) | CYP1A2HTR2CHTR2B | |
| SCHEMBL10922236 | 0.67 | SRD5A2 (0.49) | SRD5A2CYP1A2ADRA2AMAOASLC6A2 | |
| SCHEMBL1794599 | 0.66 | LSS (0.44) | CHRNA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2029594-B1 | NOVEL 1,4-DIAZA-BICYCLO[3.2.2]NONANE DERIVATIVES AND THEIR MEDICAL USE | NEUROSEARCH AS (DK) | 2010-10-20 | — | — | EP | claimed |