Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.47 |
| ▸ | MPO | P05164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1625040 | 0.91 | ALDH1A1 (0.49) | L3MBTL1ALDH1A1KDM4ELMNAMAPK1 | |
| SCHEMBL23648099 | 0.83 | APP (0.44) | L3MBTL1ALDH1A1KDM4ELMNAMAPK1 | |
| SCHEMBL4591762 | 0.83 | CYP1A2 (0.47) | ALDH1A1KDM4ELMNACYP2D6CYP2C19 | |
| SCHEMBL4406338 | 0.82 | DRD4 (0.58) | CHRM2ALDH1A1KDM4ELMNAMAPK1 | |
| SCHEMBL4599034 | 0.81 | CHRM2 (0.64) | CHRM2L3MBTL1ALDH1A1MPOKDM4E | |
| SCHEMBL6660880 | 0.81 | DRD4 (0.56) | CHRM2ALDH1A1KDM4ELMNAMAPK1 | |
| SCHEMBL7497061 | 0.81 | CHRM2 (0.55) | CHRM2L3MBTL1ALDH1A1SCN8AMPO | |
| SCHEMBL25173760 | 0.79 | SMN1; SMN2 (0.65) | L3MBTL1ALDH1A1KDM4ELMNA | |
| SCHEMBL25419906 | 0.79 | SMN1; SMN2 (0.46) | ALDH1A1KDM4ELMNAHDAC1CYP2D6 | |
| SCHEMBL17664562 | 0.79 | APP (0.51) | L3MBTL1ALDH1A1KDM4ELMNAMAPK1 |
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 |