Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | PRKACA | P17612 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.45 |
| ▸ | CDK2 | P24941 | 3/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.45 |
| ▸ | CDK9 | P50750 | 2/20 | 0.45 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 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 | |
|---|---|---|---|---|
| SCHEMBL28506391 | 1.00 | POLB (0.51) | POLBHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL30507533 | 0.86 | CDK5 (0.59) | POLBHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL28501601 | 0.86 | CDK5 (0.59) | POLBHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL28512809 | 0.80 | HSP90AA1 (0.47) | HSP90AA1AURKAPRKACAADORA2ACDK5 | |
| SCHEMBL30507526 | 0.80 | HSP90AA1 (0.47) | HSP90AA1AURKAPRKACAADORA2ACDK5 | |
| SCHEMBL3362587 | 0.78 | HSP90AA1 (0.60) | HSP90AA1AURKAPRKACAADORA2ACDK5 | |
| SCHEMBL30507329 | 0.78 | HSP90AA1 (0.60) | HSP90AA1AURKAPRKACAADORA2ACDK5 | |
| SCHEMBL30507384 | 0.78 | CHRNA7 (0.57) | POLBHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL28506385 | 0.78 | CHRNA7 (0.57) | POLBHSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL30507528 | 0.76 | HSP90AA1 (0.53) | POLBHSP90AA1AURKAPRKACAADORA2A |
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-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 |