Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 10/20 | 0.46 |
| ▸ | BRAF | P15056 | 4/20 | 0.46 |
| ▸ | RAF1 | P04049 | 2/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29840395 | 1.00 | CFTR (0.46) | CFTRBRAFRAF1EGLN1PIK3CA | |
| SCHEMBL23304256 | 0.89 | CFTR (0.49) | CFTRBRAFRAF1EGLN1PIK3CA | |
| SCHEMBL23336436 | 0.82 | CFTR (0.46) | CFTRAKT1 | |
| SCHEMBL29840296 | 0.82 | CFTR (0.46) | CFTRAKT1 | |
| SCHEMBL23303785 | 0.82 | BTK (0.50) | CFTRBRAFEGLN1 | |
| SCHEMBL23336692 | 0.80 | BRAF (0.46) | CFTRBRAFPIK3CA | |
| Hydrochloric Acid SCHEMBL23303955 | 0.79 | BRAF (0.45) | CFTRBRAFPIK3CA | |
| SCHEMBL27167851 | 0.79 | CFTR (0.43) | CFTRBRAF | |
| SCHEMBL29840276 | 0.78 | BTK (0.44) | CFTR | |
| SCHEMBL27167927 | 0.78 | CFTR (0.42) | CFTRAKT1 |
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-2021087112-A1 | CONDENSED BI-HETEROCYCLES AS INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE | BIOGEN MA INC. (US) | 2021-05-06 | — | — | WO | disclosed |