Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 9/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 9/20 | 0.39 |
| ▸ | CDK2 | P24941 | 9/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 9/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 4/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | KIF5B | P33176 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | ETV6 | P41212 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CCDC6 | Q16204 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15007036 | 0.90 | CHEK1 (0.42) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL22357 | 0.83 | CHEK1 (0.42) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15007236 | 0.82 | CHEK1 (0.37) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15031445 | 0.82 | CHEK1 (0.37) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15006972 | 0.82 | CHEK1 (0.37) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL21922 | 0.82 | CHEK1 (0.37) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL29752 | 0.82 | CHEK1 (0.37) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL20640 | 0.82 | CHEK1 (0.37) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL20972 | 0.81 | CHEK1 (0.35) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15007233 | 0.81 | CHEK1 (0.35) | CHEK1CCNA2CDK2CCNA1GRM4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012027236-A1 | NOVEL PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS | SCHERING CORPORATION (US) | 2012-03-01 | — | — | WO | disclosed |