Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 5/20 | 0.49 |
| ▸ | GSK3B | P49841 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | GPR39 | O43194 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13288652 | 0.86 | CDK2 (0.51) | CDK2GSK3BHPGDCYP1A1ALDH1A1 | |
| SCHEMBL13288648 | 0.86 | CDK2 (0.51) | CDK2GSK3BHPGDALDH1A1KDM4E | |
| SCHEMBL13288866 | 0.84 | CDK2 (0.59) | CDK2GSK3BMEN1NPC1RAB9A | |
| SCHEMBL13288770 | 0.83 | CDK2 (0.52) | CDK2GSK3BHPGDCYP1A1POLB | |
| SCHEMBL13288647 | 0.83 | GSK3B (0.41) | CDK2GSK3BHPGDALDH1A1USP2 | |
| SCHEMBL13288886 | 0.83 | CDK2 (0.52) | CDK2GSK3BHPGDCYP1A1ALDH1A1 | |
| SCHEMBL13288715 | 0.83 | ALDH1A1 (0.51) | CDK2GSK3BHPGDALDH1A1USP2 | |
| SCHEMBL13288668 | 0.83 | CDK2 (0.55) | CDK2GSK3BHPGDCYP1A1TSHR | |
| SCHEMBL13288769 | 0.83 | CDK2 (0.55) | CDK2GSK3BHPGDCYP1A1MEN1 | |
| SCHEMBL13119457 | 0.82 | CDK2 (0.73) | CDK2GSK3B |
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 |