Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 3/20 | 0.60 |
| ▸ | GSK3B | P49841 | 2/20 | 0.60 |
| ▸ | HTR1A | P08908 | 1/20 | 0.60 |
| ▸ | HTR7 | P34969 | 1/20 | 0.60 |
| ▸ | HTR2B | P41595 | 1/20 | 0.60 |
| ▸ | HTR5A | P47898 | 1/20 | 0.60 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.52 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.52 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.52 |
| ▸ | CDK9 | P50750 | 3/20 | 0.52 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.52 |
| ▸ | CDK2 | P24941 | 2/20 | 0.52 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.52 |
| ▸ | MGAM | O43451 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SI | P14410 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30507427 | 1.00 | DYRK1A (0.60) | DYRK1AGSK3BHTR1AHTR7HTR2B | |
| SCHEMBL30507329 | 0.86 | HSP90AA1 (0.60) | DYRK1AGSK3BHTR1AHTR7HTR2B | |
| SCHEMBL3362587 | 0.86 | HSP90AA1 (0.60) | DYRK1AGSK3BHTR1AHTR7HTR2B | |
| SCHEMBL11372869 | 0.79 | MGAM (0.43) | DYRK1AGSK3BHTR1AHTR7HTR2B | |
| SCHEMBL13425400 | 0.78 | GAA (0.50) | ALDH1A1RAB9AKDM4EMGAMGAA | |
| SCHEMBL13977463 | 0.77 | JAK2 (0.53) | DYRK1AGSK3BHTR1AHTR7HTR2B | |
| SCHEMBL3942360 | 0.77 | HSP90AA1 (0.76) | ALDH1A1KDM4EMGAMGAASI | |
| SCHEMBL28337754 | 0.76 | DHFR (0.52) | ALDH1A1MGAMGAASIMGAM2 | |
| SCHEMBL8592873 | 0.75 | KDM4E (0.50) | DYRK1AGSK3BHTR1AHTR7HTR2B | |
| SCHEMBL3605886 | 0.75 | HRH4 (0.54) | DYRK1AGSK3BHTR1AHTR7HTR2B |
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-112010844-B | Preparation method and application of N- (pyrimidine-2-yl) coumarin-7-amine derivative as protein kinase inhibitor | 中国药科大学 | 2023-07-25 | — | — | CN | disclosed |
| CN-112010844-A | Preparation method and application of N- (pyrimidine-2-yl) coumarin-7-amine derivative as protein kinase inhibitor | 中国药科大学 | 2020-12-01 | — | — | CN | disclosed |