Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 5/20 | 0.58 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2931062 | 0.96 | CHEK1 (0.59) | CHEK1MAP3K7HRH3ALDH1A1TBK1 | |
| SCHEMBL2932197 | 0.91 | CHEK1 (0.48) | CHEK1ALDH1A1IKBKBPARP1NPC1 | |
| SCHEMBL2930060 | 0.91 | CHEK1 (0.70) | CHEK1MAP3K7ALDH1A1TBK1IKBKB | |
| SCHEMBL2933445 | 0.90 | CHEK1 (0.72) | CHEK1MAP3K7HRH3ALDH1A1IKBKB | |
| SCHEMBL2933039 | 0.88 | CHEK1 (0.73) | CHEK1MAP3K7TBK1IKBKBPARP1 | |
| SCHEMBL2933735 | 0.88 | CHEK1 (0.44) | CHEK1MAP3K7JAK2JAK3KCNH2 | |
| SCHEMBL2932566 | 0.87 | CHEK1 (0.57) | CHEK1MAP3K7ALDH1A1IKBKBRAB9A | |
| SCHEMBL2925535 | 0.86 | JAK2 (0.43) | CHEK1HRH3TBK1JAK2JAK3 | |
| SCHEMBL2928699 | 0.86 | CHEK1 (0.59) | CHEK1MAP3K7HRH3TBK1IKBKB | |
| SCHEMBL2933336 | 0.86 | CHEK1 (0.56) | CHEK1MAP3K7HRH3IKBKBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1421074-B1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2010-09-29 | — | — | EP | claimed |