Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FLT3 | P36888 | 6/20 | 0.57 |
| ▸ | CDK7 | P50613 | 5/20 | 0.57 |
| ▸ | CCNH | P51946 | 4/20 | 0.57 |
| ▸ | CDK1 | P06493 | 3/20 | 0.57 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.57 |
| ▸ | MNAT1 | P51948 | 3/20 | 0.57 |
| ▸ | EGFR | P00533 | 7/20 | 0.49 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.45 |
| ▸ | CDK2 | P24941 | 5/20 | 0.44 |
| ▸ | IGF1R | P08069 | 2/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21600982 | 0.88 | EGFR (0.58) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL30380016 | 0.88 | CDK7 (0.59) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21600869 | 0.88 | CDK7 (0.59) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21596407 | 0.85 | FLT3 (0.48) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL28542726 | 0.85 | FLT3 (0.59) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21600952 | 0.83 | CDK2 (0.47) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21600885 | 0.83 | CDK1 (0.47) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21596354 | 0.83 | FLT3 (0.46) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21600882 | 0.83 | FLT3 (0.48) | FLT3CDK7CCNHCDK1CCNB1 | |
| SCHEMBL21600942 | 0.82 | IGF1R (0.45) | FLT3CDK7EGFRALKCDK2 |
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-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 |
| 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 |