Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 10/20 | 0.59 |
| ▸ | NAMPT | P43490 | 2/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 4/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL13288870 | 0.95 | GSK3B (0.56) | GSK3BNAMPTCHEK1CDK2CCNE1 | |
| SCHEMBL14307166 | 0.95 | GSK3B (0.56) | GSK3BNAMPTCHEK1CDK2CCNE1 | |
| SCHEMBL12954475 | 0.94 | GSK3B (0.58) | GSK3BNAMPTCHEK1TSHRLMNA | |
| SCHEMBL12954082 | 0.93 | GSK3B (0.53) | GSK3BNAMPTCHEK1CDK2CCNE1 | |
| SCHEMBL14545841 | 0.93 | GSK3B (0.56) | GSK3BNAMPTCHEK1LMNA | |
| SCHEMBL13289366 | 0.91 | GSK3B (0.55) | GSK3BNAMPTCHEK1CDK2CCNE1 | |
| SCHEMBL12953928 | 0.91 | GSK3B (0.55) | GSK3BNAMPTCHEK1CDK2TSHR | |
| SCHEMBL14607249 | 0.91 | GSK3B (0.55) | GSK3BNAMPTCHEK1CDK2LMNA | |
| SCHEMBL13289096 | 0.91 | GSK3B (0.55) | GSK3BNAMPTCHEK1CDK2TSHR | |
| SCHEMBL13289101 | 0.91 | GSK3B (0.56) | GSK3BNAMPTCHEK1CDK2CCNE1 |
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-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |