Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 2/20 | 0.47 |
| ▸ | CDK1 | P06493 | 2/20 | 0.47 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.47 |
| ▸ | FLT3 | P36888 | 2/20 | 0.47 |
| ▸ | CDK7 | P50613 | 2/20 | 0.47 |
| ▸ | CCNH | P51946 | 2/20 | 0.47 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.47 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 15/20 | 0.45 |
| ▸ | IGF1R | P08069 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600885 | 0.94 | CDK1 (0.47) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21596407 | 0.93 | FLT3 (0.48) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21600882 | 0.91 | FLT3 (0.48) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21596354 | 0.90 | FLT3 (0.46) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21600870 | 0.84 | MAPK3 (0.40) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21596372 | 0.83 | FLT3 (0.57) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21596377 | 0.83 | EGFR (0.49) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL30379774 | 0.83 | EGFR (0.49) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL21600798 | 0.82 | EGFR (0.51) | CDK2CDK1CCNB1FLT3CDK7 | |
| SCHEMBL30379569 | 0.82 | EGFR (0.51) | CDK2CDK1CCNB1FLT3CDK7 |
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-112313207-B | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2023-02-14 | — | — | CN | disclosed |
| CN-112313207-A | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2021-02-02 | — | — | CN | disclosed |
| WO-2019242689-A1 | CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2019-12-26 | — | — | WO | disclosed |