Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 13/20 | 0.49 |
| ▸ | ATRIP | Q8WXE1 | 6/20 | 0.49 |
| ▸ | MTOR | P42345 | 3/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29678426 | 0.87 | ATR (0.51) | ATRATRIPMTOR | |
| SCHEMBL23780779 | 0.87 | ATR (0.51) | ATRATRIPMTORPDPK1ROCK1 | |
| SCHEMBL23780784 | 0.87 | ATR (0.51) | ATRATRIPMTOR | |
| SCHEMBL23780781 | 0.87 | ATR (0.51) | ATRATRIPMTORPDPK1ROCK1 | |
| SCHEMBL29678485 | 0.87 | ATR (0.51) | ATRATRIPMTORPDPK1ROCK1 | |
| SCHEMBL23780785 | 0.87 | ATR (0.51) | ATRATRIPMTOR | |
| SCHEMBL30443084 | 0.86 | ATR (0.43) | ATRATRIPMTORCHEK1PDCD1 | |
| SCHEMBL25246628 | 0.86 | ATR (0.43) | ATRATRIPMTORCHEK1PDCD1 | |
| SCHEMBL25285745 | 0.86 | ATR (0.43) | ATRATRIPMTORCHEK1PDCD1 | |
| SCHEMBL23780772 | 0.85 | ATR (0.46) | ATRATRIPMTOR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023116594-A1 | SUBSTITUTED FUSED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海安诺达生物科技有限公司 | 2023-06-29 | — | — | WO | disclosed |