Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.36 |
| ▸ | LCK | P06239 | 4/20 | 0.36 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19380907 | 0.84 | LCK (0.43) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL31248850 | 0.84 | ATR (0.45) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL16147173 | 0.84 | ATR (0.45) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL19380906 | 0.83 | LCK (0.43) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL21590399 | 0.81 | CYP1A2 (0.41) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL31235341 | 0.80 | LCK (0.39) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL29955278 | 0.79 | ATR (0.44) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL3329005 | 0.78 | S1PR2 (0.41) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL3327320 | 0.78 | SCN9A (0.40) | ATRSCN9AGSK3BDYRK1APTGER1 | |
| SCHEMBL29426670 | 0.77 | LCK (0.41) | ATRSCN9AGSK3BDYRK1ALCK |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |