Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | LSS | P48449 | 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 | |
|---|---|---|---|---|
| Methane SCHEMBL17004196 | 1.00 | CHRNA7 (0.38) | CHRNA7CHRM2CHRM1CHRNB2CHRNA4 | |
| SCHEMBL1145605 | 0.99 | CHRNA7 (0.39) | CHRNA7CHRM2CHRM1CHRNB2CHRNA4 | |
| SCHEMBL1542454 | 0.82 | CHRNA7 (0.53) | CHRNA7CHRM2CHRM1NPC1RAB9A | |
| SCHEMBL1542433 | 0.82 | CHRNA7 (0.53) | CHRNA7CHRM2CHRM1NPC1RAB9A | |
| SCHEMBL1542450 | 0.82 | CHRNA7 (0.53) | CHRNA7CHRM2CHRM1NPC1RAB9A | |
| Methane SCHEMBL17004325 | 0.80 | CHRNA7 (0.47) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL1146295 | 0.79 | CHRNA7 (0.48) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL1146293 | 0.79 | CHRNA7 (0.48) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL1146544 | 0.77 | CHRNA7 (0.49) | CHRNA7CHRM2CHRM1CHRNB2CHRNA4 | |
| SCHEMBL1146543 | 0.77 | CHRNA7 (0.49) | CHRNA7CHRM2CHRM1CHRNB2CHRNA4 |
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-2099795-B1 | AZAADAMANTANE DERIVATIVES AND THEIR USES AS NICOTINIC ACETYLCHOLINE RECEPTORS LIGANDS | ABBVIE BAHAMAS LTD (BS) | 2015-08-19 | — | — | EP | disclosed |