Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.37 |
| ▸ | ATF1 | P18846 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | AKT2 | P31751 | 1/20 | 0.36 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10322984 | 0.89 | ALDH1A1 (0.46) | SMN1; SMN2POLBALDH1A1PTPN11DYRK1A | |
| SCHEMBL10324214 | 0.83 | POLB (0.45) | SMN1; SMN2POLBALDH1A1DYRK1ADYRK1B | |
| SCHEMBL10322497 | 0.77 | POLB (0.50) | SMN1; SMN2POLBALDH1A1PTPN11DYRK1A | |
| SCHEMBL10324192 | 0.77 | TNKS (0.43) | ALDH1A1DYRK1ADYRK1BLMNACASP1 | |
| SCHEMBL10323449 | 0.76 | DYRK1A (0.43) | ALDH1A1DYRK1ADYRK1BLMNACASP1 | |
| SCHEMBL10324398 | 0.75 | DYRK1A (0.52) | ALDH1A1PTPN11DYRK1ADYRK1BLMNA | |
| SCHEMBL10323404 | 0.75 | DYRK1A (0.59) | DYRK1ADYRK1B | |
| SCHEMBL10323700 | 0.71 | ALDH1A1 (0.43) | POLBALDH1A1PTPN11DYRK1ADYRK1B | |
| SCHEMBL10323016 | 0.69 | DYRK1A (0.53) | DYRK1ADYRK1B | |
| SCHEMBL10323015 | 0.69 | DYRK1A (0.53) | DYRK1ADYRK1B |
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-2012098065-A1 | PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-07-26 | — | — | WO | disclosed |