Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 14/20 | 0.45 |
| ▸ | ATRIP | Q8WXE1 | 13/20 | 0.45 |
| ▸ | MTOR | P42345 | 8/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.41 |
| ▸ | LCK | P06239 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.40 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.40 |
| ▸ | PRKDC | P78527 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | RICTOR | Q6R327 | 1/20 | 0.39 |
| ▸ | RPTOR | Q8N122 | 1/20 | 0.39 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.39 |
| ▸ | MAPKAP1 | Q9BPZ7 | 1/20 | 0.39 |
| ▸ | MLST8 | Q9BVC4 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24811649 | 0.90 | ATR (0.44) | ATRATRIPMTORLCKPIK3CA | |
| SCHEMBL24811116 | 0.89 | ATR (0.44) | ATRATRIPMTORCHEK1LCK | |
| SCHEMBL25080270 | 0.87 | MTOR (0.48) | ATRATRIPMTORPIK3CAPIK3CD | |
| SCHEMBL30443465 | 0.83 | ATR (0.61) | ATRATRIPMTORLCKPIK3CA | |
| SCHEMBL25287137 | 0.83 | ATR (0.61) | ATRATRIPMTORLCKPIK3CA | |
| SCHEMBL25287138 | 0.83 | ATR (0.61) | ATRATRIPMTORLCKPIK3CA | |
| SCHEMBL25080308 | 0.83 | MTOR (0.42) | ATRATRIPMTORPIK3CAPIK3CD | |
| SCHEMBL24810137 | 0.81 | ATR (0.46) | ATRATRIPMTORCHEK1LCK | |
| SCHEMBL24811642 | 0.80 | ATR (0.45) | ATRATRIPMTORLCKPIK3CA | |
| SCHEMBL25080311 | 0.80 | ATR (0.51) | ATRATRIPMTORCHEK1LCK |
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-2022268025-A1 | ATR INHIBITOR AND USE THEREOF | 成都苑东生物制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |