Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 4/20 | 0.51 |
| ▸ | MTOR | P42345 | 4/20 | 0.51 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.50 |
| ▸ | ATR | Q13535 | 8/20 | 0.45 |
| ▸ | ATRIP | Q8WXE1 | 7/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 7/20 | 0.45 |
| ▸ | PDCD1 | Q15116 | 7/20 | 0.45 |
| ▸ | CD274 | Q9NZQ7 | 7/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29261326 | 1.00 | PIK3CA (0.51) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL29261379 | 0.81 | GPBAR1 (0.42) | MAPT | |
| SCHEMBL29261346 | 0.81 | GPBAR1 (0.42) | MAPT | |
| SCHEMBL30233112 | 0.81 | PIK3CA (0.51) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL25099945 | 0.81 | PIK3CA (0.51) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL30516408 | 0.77 | PIK3CD (0.52) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL24453719 | 0.77 | PIK3CD (0.52) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL23848887 | 0.75 | MTOR (0.47) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL2127456 | 0.71 | ATR (0.55) | PIK3CAMTORPIK3CDATRATRIP | |
| SCHEMBL28539901 | 0.71 | ATR (0.55) | PIK3CAMTORPIK3CDATRATRIP |
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-118103369-A | Pyridolactam derivatives, preparation method and application thereof | 浙江海正药业股份有限公司 | 2024-05-28 | — | — | CN | disclosed |