Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 20/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | YES1 | P07947 | 1/20 | 0.58 |
| ▸ | FGR | P09769 | 1/20 | 0.58 |
| ▸ | TEC | P42680 | 1/20 | 0.58 |
| ▸ | BMX | P51813 | 1/20 | 0.58 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.58 |
| ▸ | CD69 | Q07108 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1726806 | 0.87 | BTK (0.76) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL1726657 | 0.81 | BTK (0.57) | BTK | |
| SCHEMBL1727062 | 0.78 | BTK (0.78) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL13186575 | 0.77 | BTK (0.64) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL13186835 | 0.76 | BTK (0.81) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL19176155 | 0.74 | BTK (0.77) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL1724824 | 0.74 | BTK (0.78) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL1726277 | 0.74 | BTK (0.62) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL29354649 | 0.73 | BTK (1.00) | BTKKCNH2YES1FGRTEC | |
| SCHEMBL29378263 | 0.73 | BTK (1.00) | BTKKCNH2YES1FGRTEC |
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-2403846-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | F. Hoffmann-La Roche AG (CH) | 2012-01-11 | — | — | EP | disclosed |
| WO-2010100070-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-10 | — | — | WO | disclosed |