Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7408578 | 0.81 | CHRNB2 (0.41) | CHRNB2CHRNA4 | |
| SCHEMBL2138712 | 0.79 | ACACB (0.37) | CD274CYP4F2CYP4A11 | |
| SCHEMBL6657708 | 0.76 | CHRNB2 (0.51) | CHRNB2CHRNA4 | |
| SCHEMBL23554569 | 0.72 | ACACB (0.40) | — | |
| SCHEMBL7417413 | 0.70 | MGLL (0.36) | CHRNB2CHRNA4CYP4F2CYP4A11 | |
| SCHEMBL7407387 | 0.70 | CHRNB2 (0.43) | CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL7411065 | 0.69 | CHRNB2 (0.42) | CHRNB2CHRNA4 | |
| SCHEMBL7581749 | 0.69 | CHRNB2 (0.52) | CHRNB2CHRNA4 | |
| SCHEMBL23529968 | 0.68 | — | — | |
| SCHEMBL7415822 | 0.68 | MEN1 (0.40) | CHRNB2CHRNA4 |
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 | disclosed |
| WO-1996040682-A1 | 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LABORATORIES (US) | 1996-12-19 | — | — | WO | disclosed |