Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.55 |
| ▸ | CDK2 | P24941 | 12/20 | 0.53 |
| ▸ | IGF1R | P08069 | 7/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | CDK7 | P50613 | 3/20 | 0.46 |
| ▸ | CDK9 | P50750 | 3/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | CDK1 | P06493 | 4/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.46 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.44 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 2/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27475476 | 0.88 | CDK2 (0.71) | CDK2IGF1RCDK7CDK9HDAC3 | |
| SCHEMBL3548956 | 0.80 | IGF1R (0.45) | IRAK4CDK2IGF1RPKMHDAC3 | |
| SCHEMBL27474684 | 0.78 | PKM (0.51) | IRAK4CDK2IGF1RPKM | |
| SCHEMBL3313332 | 0.78 | FLT3 (0.46) | IRAK4CDK2IGF1RPKMCDK7 | |
| SCHEMBL3313903 | 0.78 | IGF1R (0.61) | CDK2IGF1RKCNH2 | |
| SCHEMBL17943211 | 0.77 | CDK2 (0.77) | IRAK4CDK2IGF1RPKMCDK1 | |
| SCHEMBL23245965 | 0.76 | CDK2 (0.48) | IRAK4CDK2IGF1RPKMCDK7 | |
| SCHEMBL29884067 | 0.76 | CDK2 (0.48) | IRAK4CDK2IGF1RPKMCDK7 | |
| SCHEMBL6593868 | 0.76 | IGF1R (0.52) | CDK2IGF1RCDK1CDK19ALK | |
| SCHEMBL701008 | 0.75 | GSK3B (0.57) | IRAK4CDK2IGF1RCDK7CDK9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100415744-C | 2-arylamino-pyrimidines for the treatment of GSK3-related disorders | ASTRAZENECA AB (SE) | 2008-09-03 | — | — | CN | disclosed |
| CN-1823064-A | 2-arylamino-pyrimidines for the treatment of GSK 3-related disorders | ASTRAZENECA AB (SE) | 2006-08-23 | — | — | CN | disclosed |
| CN-1174981-C | Imidazo [1, 2-A ] pyridine and pyrazolo [2, 3-A ] pyridine derivatives | — | 2004-11-10 | — | — | CN | disclosed |