Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | NPY1R | P25929 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPY2R | P49146 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL755028 | 0.84 | CYP3A4 (0.68) | CYP3A4CYP2C19MAPTMEN1KMT2A | |
| SCHEMBL28865845 | 0.83 | PTPN2 (0.49) | MAPTTSHRMEN1KMT2AMAOB | |
| SCHEMBL25295182 | 0.81 | TSHR (0.48) | MAPTTSHRMEN1KMT2AMAOB | |
| SCHEMBL518265 | 0.80 | CYP3A4 (0.68) | CYP3A4CYP2C19MAPTMEN1KMT2A | |
| SCHEMBL16413936 | 0.79 | CYP3A4 (0.61) | CYP3A4CYP2C19MAPTMEN1KMT2A | |
| SCHEMBL13066249 | 0.77 | CYP3A4 (0.59) | CYP3A4CYP2C19MAPTMEN1KMT2A | |
| SCHEMBL29119882 | 0.77 | CYP3A4 (0.59) | CYP3A4CYP2C19MAPTTSHRMEN1 | |
| SCHEMBL29119860 | 0.76 | CYP3A4 (0.58) | CYP3A4CYP2C19MAPTMEN1KMT2A | |
| SCHEMBL29119917 | 0.76 | CYP3A4 (0.58) | CYP3A4CYP2C19MAPTMEN1KMT2A | |
| SCHEMBL18486517 | 0.76 | CYP3A4 (0.58) | CYP3A4CYP2C19MAPTMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115724884-A | Synthesis method of benzylphosphine oxide compound | 海南大学 | 2023-03-03 | — | — | CN | disclosed |