Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 4/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | STK17B | O94768 | 1/20 | 0.37 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30895246 | 1.00 | ATR (0.43) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL16147173 | 0.84 | ATR (0.45) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL31248850 | 0.84 | ATR (0.45) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL25250667 | 0.82 | GPR35 (0.43) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL29703935 | 0.81 | SCN9A (0.40) | SCN9AGSK3BDYRK1ALCKCDK9 | |
| SCHEMBL30931841 | 0.81 | ATR (0.48) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL21551425 | 0.81 | ATR (0.48) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL4443611 | 0.80 | LCK (0.41) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL22028916 | 0.79 | ATR (0.44) | ATRSCN9AGSK3BDYRK1ALCK | |
| SCHEMBL4438011 | 0.79 | ATF1 (0.42) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024091538-A1 | COMPOUNDS AND COMPOSITIONS AS GPR52 MODULATORS | NEUROCRINE BIOSCIENCES, INC. (US) | 2024-05-02 | — | — | WO | disclosed |
| WO-2024091541-A1 | COMPOUNDS AND COMPOSITIONS AS GPR52 MODULATORS | NEUROCRINE BIOSCIENCES, INC. (US) | 2024-05-02 | — | — | WO | disclosed |
| WO-2024091541-A1 | COMPOUNDS AND COMPOSITIONS AS GPR52 MODULATORS | NEUROCRINE BIOSCIENCES, INC. (US) | 2024-05-02 | — | — | WO | disclosed |