Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.46 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.37 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | F7 | P08709 | 1/20 | 0.36 |
| ▸ | F3 | P13726 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30810276 | 0.81 | PARP1 (0.45) | CHEK2MYCTYK2HDAC2KEAP1 | |
| SCHEMBL5609015 | 0.78 | CHEK2 (0.43) | CHEK2MYCCTSAHDAC2KAT6A | |
| SCHEMBL3201031 | 0.77 | PARP1 (0.46) | CTSAKEAP1NFE2L2PARP1 | |
| SCHEMBL27664694 | 0.76 | CHEK2 (0.53) | CHEK2MYCCTSATYK2HDAC2 | |
| SCHEMBL30810193 | 0.76 | HPGD (0.42) | CHEK2MYCTYK2SIRT3ADORA2A | |
| SCHEMBL3201989 | 0.75 | CTSA (0.45) | CTSAPARP1 | |
| SCHEMBL28031696 | 0.75 | SMN1; SMN2 (0.42) | CHEK2TYK2PARP1 | |
| SCHEMBL3147427 | 0.75 | ADORA2A (0.42) | CHEK2TYK2HDAC2KEAP1NFE2L2 | |
| SCHEMBL918767 | 0.74 | CSNK1A1 (0.48) | CHEK2TYK2HDAC2KEAP1NFE2L2 | |
| SCHEMBL2303493 | 0.74 | KAT6A (0.55) | CHEK2MYCHDAC2SIRT2SIRT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1805132-A2 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-07-11 | — | — | EP | disclosed |
| WO-2006110173-A2 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-19 | — | — | WO | disclosed |