Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 12/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 10/20 | 0.46 |
| ▸ | CDK2 | P24941 | 10/20 | 0.46 |
| ▸ | CCNA1 | P78396 | 10/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.39 |
| ▸ | MTOR | P42345 | 3/20 | 0.36 |
| ▸ | AKT1 | P31749 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6893499 | 1.00 | CHEK1 (0.46) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL6893521 | 0.84 | CHEK1 (0.42) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL10236611 | 0.84 | CHEK1 (0.42) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL6894334 | 0.84 | CHEK1 (0.42) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL7882256 | 0.81 | CHEK1 (0.59) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL6891847 | 0.81 | CHEK1 (0.46) | CHEK1CCNA2CDK2CCNA1KDM4E | |
| SCHEMBL594036 | 0.80 | CHEK1 (0.58) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL6894420 | 0.80 | PIK3CA (0.36) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL6894156 | 0.79 | CHEK1 (0.50) | CHEK1CCNA2CDK2CCNA1PIK3CA | |
| SCHEMBL10280501 | 0.79 | CHEK1 (0.53) | 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 |