Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 12/20 | 0.53 |
| ▸ | MARK3 | P27448 | 2/20 | 0.53 |
| ▸ | MARK4 | Q96L34 | 2/20 | 0.53 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | MET | P08581 | 4/20 | 0.47 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 5/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.45 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.44 |
| ▸ | STK16 | O75716 | 1/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.44 |
| ▸ | TYK2 | P29597 | 1/20 | 0.44 |
| ▸ | BMPR2 | Q13873 | 1/20 | 0.44 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.44 |
| ▸ | NUAK2 | Q9H093 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL13897930 | 0.91 | TBK1 (0.53) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL13897853 | 0.91 | TBK1 (0.55) | TBK1MARK3MARK4AURKAALK | |
| SCHEMBL13897737 | 0.90 | TBK1 (0.52) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL13897962 | 0.90 | TBK1 (0.52) | TBK1MARK3MARK4AURKAMET | |
| SCHEMBL13897910 | 0.89 | TBK1 (0.55) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL3866798 | 0.89 | TBK1 (0.55) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL13897876 | 0.89 | TBK1 (0.52) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL14112812 | 0.89 | TBK1 (0.51) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL3865639 | 0.89 | TBK1 (0.54) | TBK1MARK3MARK4AURKAPDPK1 | |
| SCHEMBL13898092 | 0.88 | TBK1 (0.51) | TBK1MARK3MARK4AURKAMET |
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 |
|---|---|---|---|---|---|---|---|
| US-7504410-B2 | Chk-, Pdk- and Akt-inhibitory pyrimidines, their production and use as pharmaceutical agents | SCHERING AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |