Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 13/20 | 0.44 |
| ▸ | ATRIP | Q8WXE1 | 11/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 10/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 10/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 8/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 6/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.44 |
| ▸ | MTOR | P42345 | 5/20 | 0.40 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL28784779 | 0.92 | ATR (0.44) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL28787892 | 0.84 | ATR (0.42) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL3093168 | 0.78 | PIK3CA (0.72) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL27782992 | 0.75 | ATR (0.42) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL27791257 | 0.71 | ATR (0.40) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL3076854 | 0.70 | PIK3CA (0.69) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL3077735 | 0.65 | PIK3CA (0.57) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL27787117 | 0.64 | PIK3CA (0.47) | ATRATRIPPDCD1CD274CHEK1 | |
| SCHEMBL27000319 | 0.63 | ATR (0.64) | ATRATRIP | |
| SCHEMBL25407702 | 0.62 | ATR (0.51) | ATRATRIPMTORATM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101801963-A | Trisubstituted pyrimidine derivatives for the treatment of proliferative diseases | ASTRAZENECA AB | 2010-08-11 | — | — | CN | claimed |
| CN-101801963-A | Trisubstituted pyrimidine derivatives for the treatment of proliferative diseases | ASTRAZENECA AB | 2010-08-11 | — | — | CN | disclosed |