Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.62 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.62 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.62 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.62 |
| ▸ | GSK3B | P49841 | 4/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12953639 | 0.85 | GSK3B (0.54) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL13993125 | 0.83 | CDK2 (0.67) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL30579375 | 0.83 | HSP90AA1 (0.46) | CDK2CHEK1CCNA2CCNA1HSP90AA1 | |
| SCHEMBL12953613 | 0.81 | CDK2 (0.67) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL12954497 | 0.81 | GSK3B (0.67) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL13998512 | 0.78 | GSK3B (0.62) | CDK2GSK3BKDM4EALDH1A1MEN1 | |
| SCHEMBL14582875 | 0.78 | GSK3B (0.72) | CDK2CCNA2CCNA1GSK3BMEN1 | |
| SCHEMBL14607083 | 0.78 | CDK2 (0.62) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL4177549 | 0.77 | CDK2 (1.00) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL12953365 | 0.76 | CDK2 (0.73) | CDK2CCNA2CCNA1GSK3BMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7468372-B2 | Trisubstituted 4-aminopyrazolopyrimidines as cyclin dependent kinase inhibitors | SCHERING CORPORATION (US) | 2008-12-23 | — | — | US | disclosed |
| US-7468372-B2 | Trisubstituted 4-aminopyrazolopyrimidines as cyclin dependent kinase inhibitors | SCHERING CORPORATION (US) | 2008-12-23 | — | — | US | disclosed |