Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7494433 | 0.81 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL7493937 | 0.78 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1 | |
| SCHEMBL5231668 | 0.77 | TSHR (0.33) | CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL5231676 | 0.77 | TSHR (0.33) | CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL5231682 | 0.77 | TSHR (0.33) | CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL2086358 | 0.74 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1 | |
| SCHEMBL7496103 | 0.73 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL11438967 | 0.71 | ALDH1A1 (0.33) | ALDH1A1L3MBTL1 | |
| SCHEMBL7501371 | 0.69 | CYP2D6 (0.36) | CYP2D6CYP2C19 | |
| SCHEMBL7501368 | 0.69 | CYP2D6 (0.36) | CYP2D6CYP2C19 |
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-0760362-B1 | DIAMINOMETHYLIDENE DERIVATIVE | NISSHIN SEIFUN GROUP INC (JP) | 2002-08-14 | — | — | EP | disclosed |
| US-5753654-A | GASTROINTESTINAL DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| EP-0760362-A1 | NOVEL DIAMINOMETHYLIDENE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |
| EP-0010396-A1 | Fungicidal and herbicidal compositions, certain cyanomethane and cyanoethene derivatives being active agents thereof, the preparation of these derivatives and methods for combating fungi and weeds | FBC LIMITED (GB) | 1980-04-30 | — | — | EP | disclosed |