Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 5/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 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 | |
|---|---|---|---|---|
| SCHEMBL488175 | 1.00 | ATR (0.51) | ATRKCNH2FYNL3MBTL1ERN1 | |
| SCHEMBL30454874 | 0.93 | KCNH2 (0.56) | ATRKCNH2AURKAAURKBABL1 | |
| SCHEMBL488626 | 0.93 | KCNH2 (0.56) | ATRKCNH2AURKAAURKBABL1 | |
| SCHEMBL30454051 | 0.87 | ATR (0.54) | ATRL3MBTL1CSF1R | |
| SCHEMBL488768 | 0.87 | ATR (0.54) | ATRL3MBTL1CSF1R | |
| SCHEMBL488637 | 0.84 | LDHA (0.46) | ATRPIK3CDPIK3CAPIK3CGCSF1R | |
| SCHEMBL30453342 | 0.84 | LDHA (0.46) | ATRPIK3CDPIK3CAPIK3CGCSF1R | |
| SCHEMBL488293 | 0.83 | ATR (0.48) | ATRABL1BCRCSF1R | |
| SCHEMBL488822 | 0.82 | ATR (0.53) | ATRKCNH2FYNERN1ADORA2A | |
| SCHEMBL30452937 | 0.82 | ATR (0.53) | ATRKCNH2FYNERN1ADORA2A |
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-113181362-B | Medicament for preventing and/or treating amyotrophic lateral sclerosis | 国立大学法人京都大学 | 2023-06-13 | — | — | CN | disclosed |