Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 5/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 4/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | CDC7 | O00311 | 2/20 | 0.39 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.39 |
| ▸ | PAK4 | O96013 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | PRKACA | P17612 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | FLT3 | P36888 | 2/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.39 |
| ▸ | CLK2 | P49760 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | CDK7 | P50613 | 2/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.39 |
| ▸ | PRKX | P51817 | 2/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.39 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6324540 | 0.87 | JAK3 (0.48) | BTKJAK3ROCK2CDC7DAPK3 | |
| SCHEMBL6326421 | 0.87 | BTK (0.48) | BTKKCNH2JAK3ROCK2GRM5 | |
| SCHEMBL5076306 | 0.84 | ROCK2 (0.45) | JAK3ROCK2CDC7DAPK3MAP4K4 | |
| SCHEMBL6327186 | 0.82 | CD38 (0.41) | ROCK2ROCK1PARP1GRM4JAK2 | |
| SCHEMBL6325411 | 0.80 | BRD4 (0.48) | BTKJAK3ROCK2CDC7DAPK3 | |
| SCHEMBL6325659 | 0.80 | BRD4 (0.48) | BTKJAK3ROCK2CDC7DAPK3 | |
| SCHEMBL6325665 | 0.80 | BRD4 (0.48) | BTKJAK3ROCK2CDC7DAPK3 | |
| SCHEMBL6326484 | 0.79 | JAK3 (0.48) | BTKJAK3ROCK2CDC7DAPK3 | |
| SCHEMBL6328374 | 0.77 | ROCK2 (0.42) | JAK3ROCK2CDC7DAPK3MAP4K4 | |
| SCHEMBL6328383 | 0.73 | ROCK2 (0.48) | BTKJAK3ROCK2CDC7DAPK3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6924284-B2 | PARP inhibitors | ICOS CORPORATION (US) | 2005-08-02 | — | — | US | disclosed |