Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1792649 | 0.79 | CHRNA7 (0.39) | CHRNA7CYP1A2CYP2D6NPC1RAB9A | |
| SCHEMBL1793367 | 0.77 | CHRNA7 (0.49) | CHRNA7NPC1RAB9A | |
| SCHEMBL928152 | 0.74 | MEN1 (0.41) | NPC1RAB9A | |
| SCHEMBL928386 | 0.74 | NPC1 (0.35) | CYP1A2CYP2D6NPC1RAB9A | |
| SCHEMBL928612 | 0.71 | CYP2D6 (0.35) | CYP1A2CYP2D6 | |
| SCHEMBL1791262 | 0.70 | CHRNA7 (0.48) | CHRNA7NPC1RAB9A | |
| SCHEMBL6322925 | 0.70 | ALDH1A1 (0.37) | CHRNA7CYP1A2CYP2D6 | |
| SCHEMBL929129 | 0.70 | FAAH (0.38) | CYP1A2CYP2D6NPC1RAB9A | |
| SCHEMBL929655 | 0.70 | USP30 (0.39) | CYP1A2CYP2D6 | |
| SCHEMBL927761 | 0.69 | CHRNA7 (0.67) | CHRNA7CYP2D6 |
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 |