Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 2/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.49 |
| ▸ | TEAD1 | P28347 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | CHKA | P35790 | 1/20 | 0.48 |
| ▸ | PDE2A | O00408 | 1/20 | 0.47 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13059810 | 0.86 | ALDH1A1 (0.59) | CYP2D6ALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL6265988 | 0.86 | CYP2D6 (0.65) | CYP2D6ALDH1A1MAPTCNR2LTA4H | |
| SCHEMBL3782330 | 0.86 | ALDH1A1 (0.59) | CYP2D6ALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL24460762 | 0.85 | ALDH1A1 (0.57) | CYP2D6ALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL24460563 | 0.83 | ALDH1A1 (0.55) | CYP2D6ALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL24460611 | 0.83 | ALDH1A1 (0.55) | CYP2D6ALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL6267504 | 0.82 | CYP2D6 (0.72) | CYP2D6ALDH1A1KDM4EMAPTLTA4H | |
| SCHEMBL4264871 | 0.81 | CYP2D6 (0.70) | CYP2D6ALDH1A1MAPTLTA4HLMNA | |
| SCHEMBL8326768 | 0.81 | CYP2D6 (0.66) | CYP2D6ALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL5431804 | 0.81 | CYP2D6 (0.70) | CYP2D6ALDH1A1KDM4EMAPTLTA4H |
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-0760368-B1 | PYRIMIDINE DERIVATIVES | NISSHIN FLOUR MILLING CO (JP) | 1999-07-28 | — | — | EP | disclosed |
| US-5736550-A | TREATMENT OF GASTROINTESTINAL TRACT DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-04-07 | — | — | US | disclosed |
| EP-0760368-A1 | NOVEL PYRIMIDINE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |