Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 13/20 | 0.72 |
| ▸ | JAK2 | O60674 | 13/20 | 0.72 |
| ▸ | JAK1 | P23458 | 11/20 | 0.72 |
| ▸ | TYK2 | P29597 | 4/20 | 0.72 |
| ▸ | PLK4 | O00444 | 3/20 | 0.67 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.51 |
| ▸ | CIT | O14578 | 1/20 | 0.51 |
| ▸ | GAK | O14976 | 1/20 | 0.51 |
| ▸ | OPA1 | O60313 | 1/20 | 0.51 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.51 |
| ▸ | STK16 | O75716 | 1/20 | 0.51 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.51 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.51 |
| ▸ | CDK2 | P24941 | 1/20 | 0.51 |
| ▸ | MARK3 | P27448 | 1/20 | 0.51 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28875981 | 1.00 | JAK3 (0.72) | JAK3JAK2JAK1TYK2PLK4 | |
| SCHEMBL28876010 | 0.91 | JAK2 (0.71) | JAK3JAK2JAK1TYK2PLK4 | |
| SCHEMBL29813539 | 0.91 | JAK2 (0.71) | JAK3JAK2JAK1TYK2PLK4 | |
| SCHEMBL28875985 | 0.88 | JAK3 (0.58) | JAK3JAK2JAK1TYK2PLK4 | |
| Morpholine SCHEMBL28328995 | 0.84 | PLK4 (0.53) | JAK3JAK2JAK1TYK2PLK4 | |
| SCHEMBL13859449 | 0.84 | JAK3 (0.77) | JAK3JAK2JAK1TYK2PLK4 | |
| SCHEMBL29813592 | 0.84 | JAK3 (1.00) | JAK3JAK2JAK1TYK2 | |
| SCHEMBL28876037 | 0.84 | JAK3 (1.00) | JAK3JAK2JAK1TYK2 | |
| SCHEMBL2861323 | 0.84 | JAK2 (1.00) | JAK3JAK2JAK1TYK2PLK4 | |
| SCHEMBL3691748 | 0.81 | JAK1 (0.73) | JAK3JAK2JAK1TYK2PLK4 |
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-110330484-B | Substituted phenyl pyrimidine derivative as JAK kinase inhibitor or pharmaceutically acceptable salt thereof, preparation method and application | 中国药科大学 | 2022-08-26 | — | — | CN | disclosed |