Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 16/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4358168 | 0.96 | CHRM3 (0.46) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL4352177 | 0.96 | CHRM3 (0.45) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL4347635 | 0.95 | CHRM3 (0.44) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL4088828 | 0.94 | CHRM3 (0.47) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL1363542 | 0.94 | CHRM3 (0.53) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL3428706 | 0.94 | CHRM3 (0.55) | CHRM3CHRM2CHRM1KCNH2 | |
| SCHEMBL8011358 | 0.94 | PDE4B (0.44) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL8010849 | 0.93 | PDE4B (0.43) | CHRM3PDE4BCHRM2CHRM1 | |
| SCHEMBL1365174 | 0.93 | CHRM3 (0.48) | CHRM3PDE4BCHRM2CHRM1KCNH2 | |
| SCHEMBL3425751 | 0.92 | PDE4B (0.43) | CHRM3PDE4B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2249830-A1 | DUAL PHARMACOPHORES - PDE4-MUSCARINIC ANTAGONISTICS | Glaxo Group Limited (GB) | 2010-11-17 | — | — | EP | claimed |
| WO-2009100170-A1 | DUAL PHARMACOPHORES - PDE4-MUSCARINIC ANTAGONISTICS | GLAXO GROUP LIMITED (GB) | 2009-08-13 | — | — | WO | claimed |
| WO-2009100170-A1 | DUAL PHARMACOPHORES - PDE4-MUSCARINIC ANTAGONISTICS | GLAXO GROUP LIMITED (GB) | 2009-08-13 | — | — | WO | disclosed |