Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 11/20 | 0.53 |
| ▸ | EGFR | P00533 | 2/20 | 0.47 |
| ▸ | MAPK3 | P27361 | 5/20 | 0.46 |
| ▸ | JAK2 | O60674 | 2/20 | 0.46 |
| ▸ | JAK1 | P23458 | 2/20 | 0.46 |
| ▸ | TTK | P33981 | 1/20 | 0.46 |
| ▸ | FLT3 | P36888 | 1/20 | 0.46 |
| ▸ | TXK | P42681 | 1/20 | 0.46 |
| ▸ | BLK | P51451 | 1/20 | 0.46 |
| ▸ | BTK | Q06187 | 1/20 | 0.46 |
| ▸ | ITK | Q08881 | 1/20 | 0.46 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.43 |
| ▸ | TYK2 | P29597 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600795 | 0.90 | JAK3 (0.51) | JAK3EGFR | |
| SCHEMBL28546937 | 0.88 | JAK3 (0.47) | JAK3JAK2JAK1LRRK2TYK2 | |
| SCHEMBL21596382 | 0.85 | EGFR (0.51) | JAK3EGFRMAPK3JAK2JAK1 | |
| SCHEMBL21600934 | 0.83 | EGFR (0.49) | JAK3EGFRMAPK3JAK2JAK1 | |
| SCHEMBL21601008 | 0.83 | JAK3 (0.71) | JAK3EGFRJAK2JAK1TTK | |
| SCHEMBL21596311 | 0.82 | MAPK3 (0.46) | JAK3MAPK3JAK2JAK1TYK2 | |
| SCHEMBL28525553 | 0.81 | EGFR (0.53) | EGFRMAPK3 | |
| SCHEMBL23606386 | 0.79 | JAK3 (0.45) | JAK3EGFRMAPK3BTKFGFR4 | |
| SCHEMBL30045155 | 0.79 | JAK3 (0.45) | JAK3EGFRMAPK3BTKFGFR4 | |
| SCHEMBL21601013 | 0.78 | JAK3 (0.63) | JAK3EGFRJAK2JAK1TTK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112313207-B | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2023-02-14 | — | — | CN | disclosed |
| CN-112313207-A | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2021-02-02 | — | — | CN | disclosed |
| WO-2019242689-A1 | CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2019-12-26 | — | — | WO | disclosed |