Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8554481 | 0.94 | ALDH1A1 (0.36) | CHRNA3ALDH1A1NPSR1TDP1 | |
| Hydrochloric Acid SCHEMBL7518110 | 0.93 | ALDH1A1 (0.35) | CHRNA3ALDH1A1NPSR1TDP1 | |
| SCHEMBL7405130 | 0.84 | SLC6A2 (0.39) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7408811 | 0.84 | SLC6A2 (0.39) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4961589 | 0.84 | SLC6A2 (0.39) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8550597 | 0.83 | SLC6A2 (0.35) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL7410705 | 0.83 | CHRNB2 (0.38) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8554864 | 0.83 | SLC6A2 (0.35) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL7406975 | 0.83 | CHRNB2 (0.38) | CHRNA3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7408878 | 0.82 | CHRNB2 (0.37) | ALDH1A1 |
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-0846114-A1 | 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | Abbott Laboratories (US) | 1998-06-10 | — | — | EP | claimed |
| WO-1996040682-A1 | 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LABORATORIES (US) | 1996-12-19 | — | — | WO | claimed |