Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ARHGDIA | P52565 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 3/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5833539 | 0.86 | CHRM2 (0.47) | ROCK2ARHGDIAROCK1BRD4PKM | |
| SCHEMBL5833278 | 0.84 | RNF4 (0.42) | ACHEOPRD1CHRM2CHRM3FAAH | |
| SCHEMBL5833452 | 0.84 | DCUN1D1 (0.40) | ACHE | |
| SCHEMBL5833430 | 0.82 | SIGMAR1 (0.43) | ACHECHRM2CHRM3 | |
| SCHEMBL5833024 | 0.82 | BRD4 (0.38) | ROCK2ARHGDIAROCK1BRD4PKM | |
| SCHEMBL5833937 | 0.81 | OPRD1 (0.47) | BRD4ACHEOPRD1CHRM2CHRM3 | |
| SCHEMBL5833269 | 0.80 | KDM1A (0.40) | OPRD1FAAH | |
| SCHEMBL5844904 | 0.78 | LMNA (0.38) | ROCK2ARHGDIAROCK1ACHECHRM2 | |
| SCHEMBL5833116 | 0.77 | ROCK2 (0.41) | ROCK2ARHGDIAROCK1BRD4PKM | |
| SCHEMBL5833003 | 0.76 | SIGMAR1 (0.41) | BRD4ACHECHRM2CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7008955-B2 | (2-azabicyclo[2.2.1]hept-7yl) methanol derivatives as nicotinic acetylcholine receptor agonists | MERCK PATENT GMBH (DE) | 2006-03-07 | — | — | US | claimed |