Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 5/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9348940 | 0.88 | CHRM3 (0.38) | HRH3DRD2CHRM3SMN1; SMN2 | |
| SCHEMBL9330759 | 0.87 | GNAO1 (0.50) | CHRM3 | |
| SCHEMBL9330340 | 0.85 | SMN1; SMN2 (0.40) | HRH3CHRM3SMN1; SMN2 | |
| SCHEMBL5153918 | 0.82 | GSR (0.33) | — | |
| SCHEMBL5154489 | 0.82 | SLC18A3 (0.38) | SMN1; SMN2 | |
| SCHEMBL9330490 | 0.82 | ALOX15 (0.41) | CHRM3 | |
| SCHEMBL9330735 | 0.79 | KEAP1 (0.39) | CHRM3SMN1; SMN2 | |
| SCHEMBL5148816 | 0.79 | GSR (0.35) | — | |
| SCHEMBL4889799 | 0.79 | GSR (0.39) | HRH3CHRM3 | |
| Fumaric Acid SCHEMBL9345675 | 0.78 | KCNH2 (0.43) | CHRM3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0366004-B1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| US-5280031-A | Cyclic azaaliphatic compounds with a nitroxy function, processes for the preparation thereof and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-01-18 | — | — | US | disclosed |
| US-5030641-A | Treatment of angina pectoris, hypotensive agents | BOEHRINGER MANNHEIM GMBH (DE) | 1991-07-09 | — | — | US | disclosed |
| EP-0366004-A1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | Roche Diagnostics GmbH (DE) | 1990-05-02 | — | — | EP | disclosed |