Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | AGXT | P21549 | 1/20 | 0.46 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALPG | P10696 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | NPY1R | P25929 | 1/20 | 0.42 |
| ▸ | NPY2R | P49146 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL18983328 | 0.88 | NPSR1 (0.61) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL29119882 | 0.82 | CYP3A4 (0.59) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL518265 | 0.82 | CYP3A4 (0.68) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL16413936 | 0.80 | CYP3A4 (0.61) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL20462900 | 0.80 | NPSR1 (0.57) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL28158483 | 0.80 | ALDH1A1 (0.55) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL755028 | 0.78 | CYP3A4 (0.68) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| Naphthalene SCHEMBL28276940 | 0.76 | CYP3A4 (0.61) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL22814937 | 0.76 | NPSR1 (0.50) | NPSR1CYP3A4CYP2C19ALDH1A1MEN1 | |
| SCHEMBL28050778 | 0.76 | MEN1 (0.55) | NPSR1ALDH1A1MEN1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024085676-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 솔루스첨단소재 주식회사 | 2024-04-25 | — | — | WO | disclosed |