Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7495987 | 0.83 | KMT2A (0.35) | ALDH1A1 | |
| SCHEMBL8326114 | 0.79 | MEN1 (0.48) | — | |
| SCHEMBL8327662 | 0.78 | KDM4E (0.39) | SPHK2SPHK1ALDH1A1 | |
| SCHEMBL8326334 | 0.78 | KMT2A (0.56) | ALDH1A1 | |
| SCHEMBL8325593 | 0.75 | SPHK2 (0.41) | OPRM1SPHK2SPHK1ALDH1A1 | |
| SCHEMBL8621242 | 0.74 | SPHK2 (0.38) | OPRM1SPHK2SPHK1ALDH1A1 | |
| SCHEMBL8325845 | 0.74 | SPHK2 (0.45) | SPHK2SPHK1ALDH1A1 | |
| SCHEMBL7488935 | 0.73 | DRD3 (0.51) | — | |
| SCHEMBL8328838 | 0.72 | MAPK1 (0.50) | — | |
| SCHEMBL8329414 | 0.72 | SIGMAR1 (0.53) | ALDH1A1 |
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 |
| EP-0760362-A1 | NOVEL DIAMINOMETHYLIDENE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |
| EP-0760368-A1 | NOVEL PYRIMIDINE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |