Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 20/20 | 0.68 |
| ▸ | JAK1 | P23458 | 1/20 | 0.53 |
| ▸ | JAK3 | P52333 | 1/20 | 0.53 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.53 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.53 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL30516482 | 1.00 | MAP3K14 (0.68) | MAP3K14JAK1JAK3TNK2NTRK3 | |
| SCHEMBL30516478 | 0.81 | MAP3K14 (1.00) | MAP3K14JAK1JAK3TNK2NTRK3 | |
| SCHEMBL28637439 | 0.81 | MAP3K14 (1.00) | MAP3K14JAK1JAK3TNK2NTRK3 | |
| SCHEMBL28657455 | 0.78 | TRPA1 (0.45) | MAP3K14 | |
| SCHEMBL30516518 | 0.78 | TRPA1 (0.45) | MAP3K14 | |
| SCHEMBL1611749 | 0.76 | MAP3K14 (0.61) | MAP3K14 | |
| SCHEMBL28636846 | 0.73 | MAP3K14 (1.00) | MAP3K14JAK1JAK3TNK2NTRK3 | |
| SCHEMBL30516450 | 0.73 | MAP3K14 (1.00) | MAP3K14JAK1JAK3TNK2NTRK3 | |
| SCHEMBL28638906 | 0.71 | MAP3K14 (0.68) | MAP3K14JAK1JAK3TNK2NTRK3 | |
| SCHEMBL30516458 | 0.71 | MAP3K14 (1.00) | MAP3K14JAK1JAK3TNK2NTRK3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112794855-B | Preparation method and application of N-aryl pyrimidine-4-amine derivative | 中国药科大学 | 2023-07-28 | — | — | CN | claimed |
| CN-112794855-A | N-aryl pyrimidine-4-amine derivative and application thereof | 中国药科大学 | 2021-05-14 | — | — | CN | claimed |
| CN-112794855-B | Preparation method and application of N-aryl pyrimidine-4-amine derivative | 中国药科大学 | 2023-07-28 | — | — | CN | disclosed |
| CN-112794855-A | N-aryl pyrimidine-4-amine derivative and application thereof | 中国药科大学 | 2021-05-14 | — | — | CN | disclosed |