Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 8/20 | 0.83 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL1802785 | 0.92 | CHRNA7 (0.69) | CHRNA7CHRNB4CHRNA3HTR3ACHRNB2 | |
| SCHEMBL927644 | 0.91 | CHRNA7 (1.00) | CHRNA7CHRNB4CHRNA3HTR3ACHRNB2 | |
| Trifluoroacetic Acid SCHEMBL1795329 | 0.90 | CHRNA7 (0.66) | CHRNA7CHRNB4CHRNA3HTR3A | |
| Trifluoroacetic Acid SCHEMBL1805350 | 0.83 | CHRNA7 (0.63) | CHRNA7CHRNB4CHRNA3HTR3A | |
| SCHEMBL930464 | 0.82 | CHRNA7 (0.82) | CHRNA7CHRNB4CHRNA3HTR3A | |
| SCHEMBL929184 | 0.82 | CHRNA7 (0.82) | CHRNA7CHRNB4CHRNA3HTR3ACHRNB2 | |
| SCHEMBL928550 | 0.80 | CHRNA7 (0.79) | CHRNA7CHRNB4CHRNA3HTR3A | |
| Trifluoroacetic Acid SCHEMBL1791576 | 0.77 | CHRNA7 (1.00) | CHRNA7CHRNB4CHRNA3HTR3ACHRNB2 | |
| Trifluoroacetic Acid SCHEMBL1791904 | 0.75 | CHRNA7 (0.68) | CHRNA7CHRNB4CHRNA3HTR3A | |
| SCHEMBL929483 | 0.74 | CHRNA7 (1.00) | CHRNA7CHRNB4CHRNA3HTR3A |
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 |