Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 20/20 | 0.78 |
| ▸ | GSK3B | P49841 | 2/20 | 0.67 |
| ▸ | PRKDC | P78527 | 2/20 | 0.67 |
| ▸ | ATM | Q13315 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2487043 | 0.88 | ATR (1.00) | ATRGSK3BPRKDC | |
| SCHEMBL2513720 | 0.86 | ATR (0.77) | ATRGSK3BPRKDC | |
| SCHEMBL20738827 | 0.84 | ATR (0.74) | ATRGSK3BPRKDC | |
| SCHEMBL2484419 | 0.82 | ATR (1.00) | ATRGSK3BPRKDC | |
| SCHEMBL20738828 | 0.81 | ATR (0.80) | ATRGSK3BPRKDC | |
| SCHEMBL13138213 | 0.81 | ATR (1.00) | ATRGSK3BPRKDC | |
| SCHEMBL2513058 | 0.81 | ATR (1.00) | ATRGSK3BPRKDCATM | |
| SCHEMBL13138019 | 0.80 | ATR (1.00) | ATRGSK3BPRKDC | |
| SCHEMBL2480741 | 0.79 | ATR (0.74) | ATRGSK3BPRKDC | |
| SCHEMBL2481631 | 0.79 | ATR (1.00) | ATRGSK3BPRKDC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106496209-B | Compounds useful as inhibitors of ATR kinase | 沃泰克斯药物股份有限公司 | 2020-06-30 | — | — | CN | disclosed |
| CN-106496210-B | Compounds useful as inhibitors of ATR kinase | 沃泰克斯药物股份有限公司 | 2020-06-09 | — | — | CN | disclosed |
| CN-106518856-B | Compounds useful as inhibitors of ATR kinase | 沃泰克斯药物股份有限公司 | 2020-04-28 | — | — | CN | disclosed |