Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7501368 | 1.00 | CYP2D6 (0.36) | CYP2D6CYP2C19MMP1MMP8EPHX1 | |
| SCHEMBL7493927 | 0.78 | MCL1 (0.32) | — | |
| SCHEMBL7493932 | 0.78 | MCL1 (0.32) | — | |
| SCHEMBL7494433 | 0.75 | ALDH1A1 (0.42) | CYP2D6CYP2C19MMP1MMP8MAPT | |
| SCHEMBL2086355 | 0.74 | ALDH1A1 (0.36) | TSHR | |
| SCHEMBL7496095 | 0.73 | ALDH1A1 (0.56) | CYP2C19TSHR | |
| SCHEMBL7496099 | 0.73 | ALDH1A1 (0.56) | CYP2C19TSHR | |
| SCHEMBL5231668 | 0.70 | TSHR (0.33) | CYP2D6CYP2C19MAPTTSHR | |
| SCHEMBL5231676 | 0.70 | TSHR (0.33) | CYP2D6CYP2C19MAPTTSHR | |
| SCHEMBL5231682 | 0.70 | TSHR (0.33) | CYP2D6CYP2C19MAPTTSHR |
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-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 |