Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.47 |
| ▸ | CDK2 | P24941 | 5/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | TOP2A | P11388 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12953525 | 0.89 | GSK3B (0.61) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL13304958 | 0.87 | GSK3B (0.54) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL14043294 | 0.86 | GSK3B (0.49) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL12953851 | 0.84 | GSK3B (0.59) | GSK3BCDK2CCNA2CCNA1TOP2A | |
| SCHEMBL12954304 | 0.83 | GSK3B (0.55) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL14043292 | 0.83 | GSK3B (0.57) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL13305327 | 0.80 | GSK3B (0.45) | GSK3BCDK2CCNA2CCNA1HPGD | |
| SCHEMBL13305701 | 0.80 | GSK3B (0.45) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL13305019 | 0.79 | GSK3B (0.54) | GSK3BCDK2CCNA2CCNA1ADORA2A | |
| SCHEMBL13305409 | 0.78 | GSK3B (0.58) | GSK3BCDK2CCNA2CCNA1NPC1 |
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-1537116-B1 | PYRAZOLOPYRIMIDINES SUITABLE FOR THE TREATMENT OF CANCER DISEASES | SCHERING CORP (US) | 2010-06-02 | — | — | EP | disclosed |