Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 16/20 | 0.82 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.78 |
| ▸ | IKBKB | O14920 | 1/20 | 0.76 |
| ▸ | JAK2 | O60674 | 1/20 | 0.76 |
| ▸ | JAK3 | P52333 | 1/20 | 0.76 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL7055239 | 0.90 | CHEK1 (1.00) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL7059534 | 0.88 | CHEK1 (0.73) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL7055226 | 0.87 | CHEK1 (1.00) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL13930115 | 0.87 | IKBKB (0.78) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL1385889 | 0.87 | JAK2 (1.00) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL1563740 | 0.87 | IKBKB (0.83) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL7055087 | 0.86 | IKBKB (0.78) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL1564586 | 0.83 | CHEK1 (1.00) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL1564746 | 0.83 | CHEK1 (1.00) | CHEK1MAP4K4IKBKBJAK2JAK3 | |
| SCHEMBL7059499 | 0.82 | GAA (0.73) | CHEK1MAP4K4IKBKBJAK2JAK3 |
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-2003029241-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | disclosed |