Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 6/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 10/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20432993 | 0.90 | ATR (0.47) | ATRACVR1PIK3CDPIK3CAPIK3CB | |
| SCHEMBL13138328 | 0.75 | ATR (0.40) | ATRACVR1PIK3CDPIK3CAPIK3CB | |
| SCHEMBL13138342 | 0.74 | ATR (0.48) | ATRACVR1MAPK1 | |
| SCHEMBL13138344 | 0.70 | ATR (0.41) | ATRACVR1PIK3CAMAPK1 | |
| SCHEMBL13138334 | 0.69 | ATR (0.40) | ATRACVR1PIK3CAMAPK1 | |
| SCHEMBL13138318 | 0.69 | ATR (0.39) | ATRACVR1MAPK1 | |
| SCHEMBL18180888 | 0.69 | ATR (0.51) | ATRPIK3CA | |
| SCHEMBL19672688 | 0.68 | ATR (0.47) | ATR | |
| SCHEMBL20432992 | 0.63 | ATR (0.48) | ATR | |
| SCHEMBL24248217 | 0.62 | ATR (0.60) | ATR |
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 |
|---|---|---|---|---|---|---|---|
| EP-4059932-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | Vertex Pharmaceuticals Incorporated (US) | 2022-09-21 | — | — | EP | disclosed |