Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 19/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3052935 | 1.00 | ATR (0.47) | ATRATMGSK3BPRKDCFEN1 | |
| SCHEMBL29458705 | 0.96 | ATR (0.47) | ATRATMGSK3BPRKDC | |
| SCHEMBL3059651 | 0.96 | ATR (0.47) | ATRATMGSK3BPRKDC | |
| SCHEMBL3042799 | 0.91 | ATR (0.51) | ATRATMGSK3BPRKDC | |
| SCHEMBL16069993 | 0.90 | ATR (0.54) | ATRATMGSK3BPRKDCFEN1 | |
| SCHEMBL20266546 | 0.89 | ATR (0.48) | ATRATMGSK3BPRKDC | |
| SCHEMBL3062371 | 0.89 | ATR (0.51) | ATRATMGSK3BPRKDCFEN1 | |
| SCHEMBL3050739 | 0.89 | ATR (0.47) | ATRATMGSK3BPRKDCFEN1 | |
| SCHEMBL3054965 | 0.88 | ATR (0.45) | ATRATMGSK3BPRKDCFEN1 | |
| SCHEMBL3057400 | 0.87 | ATR (0.52) | ATRATMGSK3BPRKDC |
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-3354650-B1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | VERTEX PHARMA (US) | 2022-02-16 | — | — | EP | disclosed |