Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 3/20 | 0.64 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.64 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.64 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.64 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.64 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.56 |
| ▸ | CHRNG | P07510 | 1/20 | 0.56 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.56 |
| ▸ | CHRND | Q07001 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL18291207 | 0.90 | CHRNA3 (0.67) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| Benzoic Acid SCHEMBL7413231 | 0.87 | CHRNA3 (0.50) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL7913611 | 0.81 | CHRNB2 (0.68) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL2437188 | 0.81 | CHRNB2 (0.68) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL7407230 | 0.81 | CHRNB2 (0.68) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| Hydrochloric Acid SCHEMBL7460292 | 0.80 | CHRNB2 (0.66) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL23498464 | 0.80 | CHRNB2 (0.69) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL4651869 | 0.80 | CHRNB2 (0.69) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL8437911 | 0.80 | CHRNB2 (0.69) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL30510968 | 0.80 | CHRNB2 (0.69) | CHRNA3CHRNA7CHRNB2CHRNB4CHRNA4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047690-A1 | HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | Abbott Laboratories (US) | 2000-11-02 | — | — | EP | claimed |
| WO-1999032480-A1 | HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LABORATORIES (US) | 1999-07-01 | — | — | WO | claimed |
| EP-1047690-A1 | HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | Abbott Laboratories (US) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999032480-A1 | HETEROCYCLIC ETHER AND THIOETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LABORATORIES (US) | 1999-07-01 | — | — | WO | disclosed |