Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100B | P04271 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | IGLV6-57 | P01721 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29559520 | 1.00 | S100B (0.40) | S100BCASRARALDH1A1L3MBTL1 | |
| SCHEMBL22897580 | 0.86 | S100B (0.55) | S100BALDH1A1L3MBTL1MAPK1PSMD14 | |
| SCHEMBL29559798 | 0.86 | S100B (0.55) | S100BALDH1A1L3MBTL1MAPK1PSMD14 | |
| SCHEMBL3288762 | 0.77 | S100B (0.52) | S100BARALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL12674065 | 0.76 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1MAPK1CYP3A4TSHR | |
| SCHEMBL12674293 | 0.75 | ADORA2A (0.39) | ALDH1A1TDP1KDM4E | |
| SCHEMBL7100535 | 0.73 | S100B (0.72) | S100BARALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL22897746 | 0.72 | AAK1 (0.37) | ALDH1A1L3MBTL1SMN1; SMN2NPBWR1MCHR1 | |
| SCHEMBL29559244 | 0.72 | AAK1 (0.37) | ALDH1A1L3MBTL1SMN1; SMN2NPBWR1MCHR1 | |
| SCHEMBL21031712 | 0.72 | S100B (0.43) | S100BARALDH1A1L3MBTL1MAPK1 |
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-2021011722-A1 | MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2021-01-21 | — | — | WO | disclosed |