Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 10/20 | 0.50 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.49 |
| ▸ | CLK1 | P49759 | 7/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30219604 | 1.00 | MAP3K14 (0.50) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 | |
| SCHEMBL1612797 | 0.76 | DHFR (0.45) | — | |
| SCHEMBL25247947 | 0.68 | MAP3K14 (1.00) | MAP3K14 | |
| SCHEMBL25247949 | 0.68 | MAP3K14 (1.00) | MAP3K14 | |
| SCHEMBL28986332 | 0.67 | MAPKAPK2 (0.60) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 | |
| SCHEMBL30219627 | 0.67 | MAPKAPK2 (0.60) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 | |
| SCHEMBL30219575 | 0.66 | MAP3K14 (0.54) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 | |
| SCHEMBL28986214 | 0.66 | MAP3K14 (0.54) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 | |
| SCHEMBL19671051 | 0.64 | MAPKAPK2 (0.46) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 | |
| SCHEMBL15730201 | 0.64 | MAPKAPK2 (0.46) | MAP3K14MAPKAPK2CLK1CDK5CDK5R1 |
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 |