Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 16/20 | 0.53 |
| ▸ | IKBKB | O14920 | 2/20 | 0.45 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.45 |
| ▸ | MELK | Q14680 | 3/20 | 0.45 |
| ▸ | PLK4 | O00444 | 1/20 | 0.45 |
| ▸ | GAK | O14976 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | ULK1 | O75385 | 1/20 | 0.45 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.45 |
| ▸ | STK10 | O94804 | 1/20 | 0.45 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | PAK4 | O96013 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.45 |
| ▸ | FES | P07332 | 1/20 | 0.45 |
| ▸ | YES1 | P07947 | 1/20 | 0.45 |
| ▸ | LYN | P07948 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1564520 | 0.78 | CHEK1 (0.80) | CHEK1CDK2AP1MELKPLK4GAK | |
| SCHEMBL1562857 | 0.77 | CHEK1 (0.69) | CHEK1IKBKBCDK2AP1JAK2MAP4K4 | |
| SCHEMBL1562872 | 0.75 | CHEK1 (0.84) | CHEK1CDK2AP1MELKPLK4GAK | |
| SCHEMBL20344016 | 0.73 | SCN9A (0.58) | IKBKB | |
| SCHEMBL1382530 | 0.73 | IKBKB (0.78) | IKBKB | |
| SCHEMBL4224398 | 0.72 | CHEK1 (0.59) | CHEK1CDK2AP1 | |
| SCHEMBL3076668 | 0.72 | PTPN1 (0.75) | IKBKB | |
| SCHEMBL1562946 | 0.70 | CHEK1 (0.95) | CHEK1CDK2AP1MELKPLK4GAK | |
| SCHEMBL1564687 | 0.69 | CHEK1 (0.61) | CHEK1 | |
| SCHEMBL5551102 | 0.69 | CHEK1 (0.57) | CHEK1CDK2AP1MELKPLK4GAK |
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-2305671-A1 | Thiophene and thiazole derivatives as CHK1 inhibitors | AstraZeneca AB (SE) | 2011-04-06 | — | — | EP | disclosed |