Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 2/20 | 0.50 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.50 |
| ▸ | CDK4 | P11802 | 8/20 | 0.49 |
| ▸ | CCND1 | P24385 | 4/20 | 0.49 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 4/20 | 0.47 |
| ▸ | INSR | P06213 | 3/20 | 0.47 |
| ▸ | CDK1 | P06493 | 2/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | FLT4 | P35916 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | CDK7 | P50613 | 1/20 | 0.47 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.47 |
| ▸ | WEE1 | P30291 | 5/20 | 0.45 |
| ▸ | CCND2 | P30279 | 3/20 | 0.45 |
| ▸ | CCND3 | P30281 | 3/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | RPS6KA6 | Q9UK32 | 1/20 | 0.45 |
| ▸ | IGF1R | P08069 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20012904 | 0.91 | CDK4 (0.54) | PDGFRBPDGFRACDK4CCND1CDK6 | |
| SCHEMBL20012906 | 0.90 | CDK4 (0.46) | CDK4CCND1AURKACDK1KDR | |
| SCHEMBL20012945 | 0.87 | INSR (0.62) | PDGFRBPDGFRAAURKAINSRSRC | |
| SCHEMBL20012932 | 0.85 | FGFR3 (0.58) | KDREGFRFGFR1FGFR2FGFR4 | |
| SCHEMBL20012936 | 0.84 | WEE1 (0.47) | CDK4CDK6WEE1JAK2EGFR | |
| SCHEMBL20012903 | 0.81 | SYK (0.53) | CDK4CCND1CDK6AURKACCND2 | |
| SCHEMBL20012991 | 0.81 | FGFR1 (0.53) | PDGFRBPDGFRACDK4CCND1AURKA | |
| SCHEMBL20012916 | 0.80 | JAK2 (0.60) | CDK4CDK6AURKACCND3JAK2 | |
| SCHEMBL20012920 | 0.79 | TTK (0.57) | INSRIGF1RALKEGFRFGFR1 | |
| SCHEMBL20012912 | 0.79 | ALK (0.62) | PDGFRBPDGFRACDK4CDK6AURKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018056621-A1 | NOVEL IMIDAZOLYL PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF CANCER | 재단법인 대구경북첨단의료산업진흥재단 | 2018-03-29 | — | — | WO | disclosed |