Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 5/20 | 0.39 |
| ▸ | KCNE1 | P15382 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.39 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3751751 | 0.89 | SLC6A2 (0.52) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL3305482 | 0.81 | SLC6A3 (0.41) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL6537851 | 0.81 | CYP1A2 (0.42) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL7517110 | 0.76 | SLC6A2 (0.52) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL4980374 | 0.72 | SLC6A3 (0.48) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL8815913 | 0.72 | SLC6A2 (0.48) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL7126297 | 0.72 | SLC6A2 (0.44) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL9185638 | 0.71 | SLC6A3 (0.56) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL2339352 | 0.71 | S1PR2 (0.50) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E | |
| SCHEMBL833118 | 0.69 | CYP1A2 (0.46) | SLC6A3SLC6A2SLC6A4NPSR1KDM4E |
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-0793656-B1 | NOVEL BENZYL PYRIMIDINES | BASILEA PHARMACEUTICA AG (CH) | 2003-03-26 | — | — | EP | disclosed |
| US-5763450-A | BACTERICIDES; TREATMENT OF INFECTIOUS DISEASES | HOFFMANN-LA ROCHE INC. (US) | 1998-06-09 | — | — | US | disclosed |
| EP-0793656-A1 | NOVEL BENZYL PYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-09-10 | — | — | EP | disclosed |
| WO-1996016046-A2 | NOVEL BENZYL PYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 1996-05-30 | — | — | WO | disclosed |