Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 7/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.36 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 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 | |
|---|---|---|---|---|
| SCHEMBL11931583 | 0.89 | CHEK1 (0.51) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14232557 | 0.86 | CHEK1 (0.49) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14218632 | 0.85 | CHEK1 (0.45) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14232556 | 0.85 | CHEK1 (0.47) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14218610 | 0.85 | CHEK1 (0.53) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14232555 | 0.85 | JAK1 (0.50) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14232209 | 0.85 | CHEK1 (0.48) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14218608 | 0.84 | JAK1 (0.40) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14218607 | 0.84 | CHEK1 (0.53) | PIK3CACHEK1PIK3CDJAK1ROCK2 | |
| SCHEMBL14218631 | 0.83 | CHEK1 (0.43) | PIK3CACHEK1PIK3CDJAK1ROCK2 |
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-2008045266-A2 | PYRAZOLOPYRIMIDIWES AS CYCLIN DEPENDENT KINASE INHIBITOR | SCHERING CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |