Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.46 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.39 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.39 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.39 |
| ▸ | BMPR2 | Q13873 | 1/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30501359 | 0.99 | IRAK4 (0.45) | IRAK4CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL30501200 | 0.94 | IRAK4 (0.46) | IRAK4CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL30501443 | 0.92 | CDK2 (0.40) | IRAK4CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL30501447 | 0.92 | PIK3CD (0.41) | IRAK4CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL30501226 | 0.91 | CDK2 (0.42) | IRAK4CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL30501262 | 0.91 | PRKCA (0.39) | IRAK4CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL30501205 | 0.89 | CSF1R (0.41) | IRAK4GSK3BMAPTALDH1A1TGFBR1 | |
| SCHEMBL30501355 | 0.88 | IRAK4 (0.45) | IRAK4CDK2GSK3BALDH1A1PIK3CD | |
| SCHEMBL30501388 | 0.87 | JAK2 (0.44) | IRAK4ALDH1A1PIK3CDJAK2PIK3CA | |
| SCHEMBL30501435 | 0.86 | CHEK1 (0.49) | IRAK4CHEK1HDAC6 |
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-111032642-B | Kinase inhibitors and methods of making and using the same | 里格尔药品股份有限公司 | 2023-07-18 | — | — | CN | disclosed |