Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 20/20 | 0.72 |
| ▸ | PRKDC | P78527 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL19102095 | 0.88 | ATR (0.70) | ATRPRKDC | |
| SCHEMBL19102194 | 0.85 | ATR (0.73) | ATRPRKDC | |
| SCHEMBL19102163 | 0.84 | ATR (0.77) | ATRPRKDC | |
| SCHEMBL13138646 | 0.84 | ATR (1.00) | ATR | |
| SCHEMBL2484696 | 0.84 | ATR (1.00) | ATR | |
| SCHEMBL19102144 | 0.84 | ATR (0.73) | ATRPRKDC | |
| SCHEMBL16424874 | 0.78 | ATR (1.00) | ATRPRKDC | |
| SCHEMBL13138597 | 0.78 | ATR (1.00) | ATRPRKDC | |
| SCHEMBL2486916 | 0.78 | ATR (1.00) | ATRPRKDC | |
| SCHEMBL31388063 | 0.78 | ATR (0.60) | ATRPRKDC |
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 |
|---|---|---|---|---|---|---|---|
| US-9701674-B2 | Substituted pyrazines as ATR kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2017-07-11 | — | — | US | disclosed |