Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 6/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.34 |
| ▸ | CDK2 | P24941 | 5/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 5/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.32 |
| ▸ | AKT1 | P31749 | 2/20 | 0.31 |
| ▸ | MTOR | P42345 | 2/20 | 0.31 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.31 |
| ▸ | STK10 | O94804 | 1/20 | 0.31 |
| ▸ | LATS1 | O95835 | 1/20 | 0.31 |
| ▸ | PAK4 | O96013 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | NQO2 | P16083 | 1/20 | 0.31 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.31 |
| ▸ | MARK3 | P27448 | 1/20 | 0.31 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.31 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.31 |
| ▸ | PRKCI | P41743 | 1/20 | 0.31 |
| ▸ | PSMC4 | P43686 | 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 | |
|---|---|---|---|---|
| SCHEMBL7879077 | 0.96 | CHEK1 (0.32) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL2680019 | 0.91 | CHEK1 (0.31) | CHEK1CCNA2CDK2CCNA1MTOR | |
| SCHEMBL2680181 | 0.90 | DGAT1 (0.36) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL6889950 | 0.88 | CHEK1 (0.32) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL10237696 | 0.88 | — | — | |
| SCHEMBL584589 | 0.88 | DGAT1 (0.38) | CHEK1PIK3CAAKT1MTOR | |
| SCHEMBL7886269 | 0.87 | PIK3CA (0.33) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL594420 | 0.87 | PIK3CA (0.33) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL7883024 | 0.84 | PIK3CA (0.33) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL7883428 | 0.84 | PIK3CA (0.32) | CHEK1CCNA2CDK2CCNA1PIK3CA |
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-2010118207-A1 | PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS | SCHERING CORPORATION (US) | 2010-10-14 | — | — | WO | disclosed |