Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 5/20 | 0.74 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL928155 | 0.89 | CHRNA7 (0.67) | CHRNA7KCNH2CHRNA4CHRNB2CHRNB4 | |
| Trifluoroacetic Acid SCHEMBL1791576 | 0.85 | CHRNA7 (1.00) | CHRNA7KCNH2CHRNA4CHRNB2CHRNB4 | |
| Trifluoroacetic Acid SCHEMBL927721 | 0.84 | CHRNA7 (0.83) | CHRNA7KCNH2CHRNA4CHRNB2CHRNB4 | |
| Trifluoroacetic Acid SCHEMBL1791261 | 0.83 | CHRNA7 (0.81) | CHRNA7KCNH2CHRNB4CHRNA3HTR3A | |
| Trifluoroacetic Acid SCHEMBL1793074 | 0.82 | CHRNA4 (0.58) | CHRNA7CHRNA4CHRNB2CHRNB4CHRNA3 | |
| Trifluoroacetic Acid SCHEMBL1792510 | 0.82 | CHRNA7 (0.76) | CHRNA7KCNH2CHRNA4CHRNB2CHRNB4 | |
| Trifluoroacetic Acid SCHEMBL6324918 | 0.79 | CHRNA7 (0.78) | CHRNA7KCNH2CHRNB4CHRNA3HTR3A | |
| Trifluoroacetic Acid SCHEMBL1792771 | 0.79 | CHRNA7 (0.78) | CHRNA7KCNH2CHRNB4CHRNA3HTR3A | |
| Trifluoroacetic Acid SCHEMBL1792562 | 0.78 | CHRNA7 (0.74) | CHRNA7KCNH2CHRNB4CHRNA3HTR3A | |
| SCHEMBL2328660 | 0.77 | CHRNA7 (0.50) | CHRNA7KCNH2CHRNA4CHRNB4CHRNA3 |
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-2316836-A1 | Substituted diazabicycloalkane derivatives as ligands at alpha 7 nicotinic acetylcholine receptors | Abbott Laboratories (US) | 2011-05-04 | — | — | EP | disclosed |