Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA4 | P43681 | 17/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 16/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 16/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 16/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 14/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3397031 | 1.00 | CHRNA4 (0.43) | CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL5777875 | 0.82 | CHRNB2 (0.30) | CHRNA4CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL8329981 | 0.78 | CHRM2 (0.37) | NR1H2 | |
| SCHEMBL8329335 | 0.78 | CHRM2 (0.37) | NR1H2 | |
| SCHEMBL14764516 | 0.78 | CHRM2 (0.41) | NR1H2 | |
| SCHEMBL3647706 | 0.76 | NR1H2 (0.31) | NR1H2 | |
| SCHEMBL4711086 | 0.76 | NR1H2 (0.31) | NR1H2 | |
| SCHEMBL4584160 | 0.75 | CHRM2 (0.35) | NR1H2 | |
| SCHEMBL649983 | 0.75 | CHRNB2 (0.65) | CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL16053523 | 0.75 | CHRNB2 (0.65) | CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1776372-A1 | SUBSTITUTED, BICYCLIC 8-PYRROLIDINOXANTHINES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | Sanofi-Aventis Deutschland GmbH (DE) | 2007-04-25 | — | — | EP | disclosed |
| WO-2006015701-A1 | SUBSTITUTED, BICYCLIC 8-PYRROLIDINOXANTHINES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2006-02-16 | — | — | WO | disclosed |