Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 17/20 | 0.43 |
| ▸ | ATRIP | Q8WXE1 | 16/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 7/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 7/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 7/20 | 0.43 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28577379 | 1.00 | ATR (0.43) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL28576636 | 0.81 | ATR (0.47) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL28576635 | 0.81 | ATR (0.47) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL23408531 | 0.81 | MTOR (0.42) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL29738240 | 0.81 | MTOR (0.42) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL28584100 | 0.81 | MTOR (0.42) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL23629232 | 0.79 | ATR (0.38) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL23629225 | 0.74 | ATR (0.45) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL23629214 | 0.74 | ATR (0.43) | ATRATRIPCHEK1PDCD1CD274 | |
| SCHEMBL28584789 | 0.74 | ATR (0.47) | ATRATRIPCHEK1PDCD1CD274 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112851668-A | ATR inhibitor and application thereof in medicine | 贝达药业股份有限公司 | 2021-05-28 | — | — | CN | disclosed |