Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.58 |
| ▸ | CDK2 | P24941 | 7/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CLK1 | P49759 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13308740 | 0.88 | GSK3B (0.76) | GSK3BCDK2CCNA2CCNA1KDM4E | |
| SCHEMBL13309082 | 0.86 | GSK3B (0.46) | GSK3BCDK2KDM4EALDH1A1LMNA | |
| SCHEMBL13885032 | 0.78 | GSK3B (0.79) | GSK3BCDK2CCNA2CCNA1 | |
| SCHEMBL13885030 | 0.78 | GSK3B (0.70) | GSK3BCDK2CCNA2CCNA1 | |
| SCHEMBL14050973 | 0.76 | GSK3B (0.62) | GSK3BCDK2CCNA2CCNA1LMNA | |
| SCHEMBL13309399 | 0.76 | MAPK1 (0.45) | GSK3BCDK2KDM4EALDH1A1LMNA | |
| SCHEMBL13893805 | 0.76 | GSK3B (0.48) | GSK3BCDK2KDM4EALDH1A1LMNA | |
| SCHEMBL13309467 | 0.75 | GSK3B (0.67) | GSK3BCDK2CCNA2CCNA1 | |
| SCHEMBL12953482 | 0.74 | GSK3B (0.77) | GSK3BCDK2CCNA2CCNA1 | |
| SCHEMBL13309050 | 0.74 | ALDH1A1 (0.47) | GSK3BKDM4EALDH1A1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1934224-B1 | PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS FOR THE TREATMENT OF CANCER | SCHERING CORP (US) | 2010-06-09 | — | — | EP | disclosed |