Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 18/20 | 0.49 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600758 | 0.88 | MAPK3 (0.54) | ALKMAPK3 | |
| SCHEMBL30379344 | 0.88 | MAPK3 (0.54) | ALKMAPK3 | |
| SCHEMBL21596358 | 0.86 | MAPK3 (0.47) | ALKMAPK3IGF1RCDK2 | |
| SCHEMBL21596373 | 0.85 | MAPK3 (0.47) | ALKMAPK3IGF1R | |
| SCHEMBL21600829 | 0.85 | MAPK3 (0.46) | ALKMAPK3IGF1R | |
| SCHEMBL28953574 | 0.84 | ALK (0.53) | ALKIGF1RCDK2 | |
| SCHEMBL30379442 | 0.84 | SYK (0.50) | ALKIGF1RCDK2 | |
| SCHEMBL21596348 | 0.84 | ALK (0.54) | ALKMAPK3IGF1RCDK2 | |
| SCHEMBL21600801 | 0.84 | MAPK3 (0.44) | ALKMAPK3IGF1RCDK2 | |
| SCHEMBL21596388 | 0.83 | MAPK3 (0.44) | ALKMAPK3IGF1R |
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 |
|---|---|---|---|---|---|---|---|
| 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 |