Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 13/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4061221 | 0.84 | HRH3 (0.35) | HRH3CHRM2CHRM3EPHX2 | |
| SCHEMBL18422101 | 0.83 | CHRM2 (0.42) | CHRM2CHRM3EPHX2 | |
| SCHEMBL30545528 | 0.80 | CHRM2 (0.39) | CHRM2CHRM3EPHX2 | |
| SCHEMBL4065681 | 0.78 | HRH3 (0.35) | HRH3CHRM2CHRM3KCNH2 | |
| SCHEMBL19097004 | 0.77 | EPHX2 (0.44) | CHRM2CHRM3EPHX2 | |
| SCHEMBL477138 | 0.76 | CHRM2 (0.37) | CHRM2CHRM3EPHX2 | |
| SCHEMBL31548277 | 0.75 | CNR2 (0.37) | CHRM2CHRM3EPHX2 | |
| SCHEMBL30900658 | 0.73 | VNN1 (0.38) | CHRM2CHRM3KCNH2EPHX2 | |
| SCHEMBL31027914 | 0.73 | CHRM2 (0.34) | CHRM2CHRM3EPHX2 | |
| SCHEMBL4072607 | 0.73 | HRH3 (0.47) | HRH3KCNH2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2032535-B1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI SA (FR) | 2012-08-01 | — | — | EP | claimed |
| EP-2032535-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | Sanofi-Aventis (FR) | 2009-03-11 | — | — | EP | claimed |
| WO-2007137738-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI-AVENTIS (DE) | 2007-12-06 | — | — | WO | claimed |
| EP-2520568-A1 | Spirocyclic nitriles as inhibitors of protease | SANOFI (FR) | 2012-11-07 | — | — | EP | disclosed |
| EP-2032535-B1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI SA (FR) | 2012-08-01 | — | — | EP | disclosed |
| EP-2032535-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | Sanofi-Aventis (FR) | 2009-03-11 | — | — | EP | disclosed |
| WO-2007137738-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI-AVENTIS (DE) | 2007-12-06 | — | — | WO | disclosed |