Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 4/20 | 0.44 |
| ▸ | INSR | P06213 | 3/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.39 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.39 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.38 |
| ▸ | PRKDC | P78527 | 2/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | NPM1 | P06748 | 1/20 | 0.35 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29449466 | 0.94 | ALK (0.41) | ALKINSREGFRIGF1RCHEK1 | |
| SCHEMBL29449464 | 0.89 | MAP3K12 (0.41) | ALKINSREGFRIGF1RCHEK1 | |
| SCHEMBL29449461 | 0.86 | HTR1A (0.39) | ALKEGFRIGF1RCHEK1PIK3CA | |
| SCHEMBL29449463 | 0.85 | CCNT1 (0.39) | CHEK1PIK3CAPRKDCMAPK3MAPK1 | |
| SCHEMBL29449465 | 0.83 | CDK9 (0.43) | ALKEGFRMAPK9MAPK10MAPK1 | |
| SCHEMBL28710161 | 0.83 | ALK (0.60) | ALKINSREGFRIGF1RCHEK1 | |
| SCHEMBL28689797 | 0.78 | ALK (0.54) | ALKINSREGFRIGF1RCHEK1 | |
| SCHEMBL29449462 | 0.77 | CHEK1 (0.47) | ALKEGFRCHEK1MAPK9MAPK10 | |
| SCHEMBL28703584 | 0.72 | ALK (0.51) | ALKINSREGFRIGF1RMAPK3 | |
| SCHEMBL29449460 | 0.69 | TYK2 (0.47) | ALKINSREGFRJAK2JAK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114181257-B | Pyridine compound, pharmaceutical composition containing same, preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2025-02-14 | — | — | CN | disclosed |
| CN-114181257-A | Pyridine compound, pharmaceutical composition containing pyridine compound, preparation method and application of pyridine compound | 四川科伦博泰生物医药股份有限公司 | 2022-03-15 | — | — | CN | disclosed |