Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 15/20 | 0.46 |
| ▸ | WEE1 | P30291 | 4/20 | 0.43 |
| ▸ | AXL | P30530 | 2/20 | 0.42 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.42 |
| ▸ | MERTK | Q12866 | 2/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | STK16 | O75716 | 1/20 | 0.42 |
| ▸ | CDKL5 | O76039 | 1/20 | 0.42 |
| ▸ | LATS1 | O95835 | 1/20 | 0.42 |
| ▸ | PAK4 | O96013 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | LYN | P07948 | 1/20 | 0.42 |
| ▸ | RET | P07949 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | FER | P16591 | 1/20 | 0.42 |
| ▸ | FLT1 | P17948 | 1/20 | 0.42 |
| ▸ | ERCC2 | P18074 | 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 | |
|---|---|---|---|---|
| SCHEMBL29051789 | 0.92 | WEE1 (0.45) | PTK2WEE1AXLTYRO3MERTK | |
| SCHEMBL29051823 | 0.89 | PTK2 (0.49) | PTK2WEE1PTK2B | |
| SCHEMBL29051916 | 0.87 | STK17B (0.46) | PTK2WEE1AURKAJAK2STK16 | |
| SCHEMBL29051836 | 0.86 | CDK4 (0.44) | PTK2CDK1CCNA2CDK2CDK7 | |
| Hydrochloric Acid SCHEMBL29051704 | 0.85 | CSF1R (0.45) | PTK2WEE1AXLTYRO3MERTK | |
| SCHEMBL30468427 | 0.83 | PTK2 (0.45) | PTK2WEE1AXLTYRO3MERTK | |
| SCHEMBL30468423 | 0.83 | PTK2 (0.54) | PTK2WEE1AURKAJAK2STK16 | |
| Hydrochloric Acid SCHEMBL29051773 | 0.83 | PTK2 (0.44) | PTK2WEE1AXLTYRO3MERTK | |
| Hydrochloric Acid SCHEMBL29051834 | 0.82 | PTK2 (0.53) | PTK2WEE1AURKAJAK2STK16 | |
| SCHEMBL29051801 | 0.81 | PTK2 (0.50) | PTK2AXLAURKAJAK2STK16 |
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-116332910-A | 2-aminopyrimidine derivatives as kinase inhibitors, preparation and use thereof | 江苏威凯尔医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |