Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 5/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.30 |
| ▸ | ACVR1 | Q04771 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20433209 | 0.82 | ATR (0.47) | ATRACVR1 | |
| SCHEMBL20432976 | 0.80 | ATR (0.55) | ATR | |
| SCHEMBL20433508 | 0.78 | ATR (0.46) | ATRPARP1PARP2ACVR1 | |
| SCHEMBL24681817 | 0.77 | ATR (0.63) | ATRACVR1 | |
| SCHEMBL24681422 | 0.76 | ATR (0.47) | ATRACVR1 | |
| SCHEMBL20433235 | 0.75 | ATR (0.40) | ATR | |
| SCHEMBL13346062 | 0.73 | ATR (0.42) | ATRACVR1 | |
| SCHEMBL13138295 | 0.73 | ATR (0.52) | ATRACVR1 | |
| SCHEMBL13138298 | 0.73 | ATR (0.52) | ATRACVR1 | |
| SCHEMBL20433187 | 0.73 | ATR (0.43) | 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 2 patents. 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 |
| EP-3354650-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | Vertex Pharmaceuticals Incorporated (US) | 2018-08-01 | — | — | EP | disclosed |