Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 15/20 | 0.56 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.48 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30219609 | 1.00 | MAP3K14 (0.56) | MAP3K14MAPKAPK2PTK2 | |
| SCHEMBL30219596 | 0.87 | MAPKAPK2 (0.53) | MAP3K14MAPKAPK2PTK2 | |
| SCHEMBL28986237 | 0.87 | MAPKAPK2 (0.53) | MAP3K14MAPKAPK2PTK2 | |
| SCHEMBL30219630 | 0.87 | MAPKAPK2 (0.47) | MAP3K14MAPKAPK2PTK2 | |
| SCHEMBL30219543 | 0.82 | MAPKAPK2 (0.46) | MAP3K14MAPKAPK2PTK2 | |
| SCHEMBL30219552 | 0.78 | MAPKAPK2 (0.56) | MAP3K14MAPKAPK2 | |
| SCHEMBL28986278 | 0.78 | MAPKAPK2 (0.56) | MAP3K14MAPKAPK2 | |
| SCHEMBL30219632 | 0.76 | MAPKAPK2 (0.56) | MAP3K14MAPKAPK2 | |
| SCHEMBL28986263 | 0.76 | MAPKAPK2 (0.56) | MAP3K14MAPKAPK2 | |
| SCHEMBL28986210 | 0.75 | MAPKAPK2 (0.53) | MAP3K14MAPKAPK2 |
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-109810110-B | Compound with 2-aminopyrimidine structure, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-01-24 | — | — | CN | disclosed |