Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL20029658 | 0.88 | CFTR (0.40) | CFTR | |
| SCHEMBL20582065 | 0.87 | CFTR (0.42) | CFTR | |
| SCHEMBL21245162 | 0.86 | CFTR (0.38) | CFTR | |
| SCHEMBL21245268 | 0.85 | PKM (0.32) | CFTR | |
| SCHEMBL20023965 | 0.85 | CFTR (0.39) | CFTR | |
| SCHEMBL21244608 | 0.84 | CFTR (0.34) | CFTR | |
| SCHEMBL21244445 | 0.83 | CFTR (0.33) | CFTR | |
| SCHEMBL21245052 | 0.83 | CFTR (0.37) | CFTR | |
| SCHEMBL20029455 | 0.80 | CFTR (0.40) | CFTRSCN9A | |
| SCHEMBL20029653 | 0.78 | CFTR (0.37) | CFTR |
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-3752510-A1 | MACROCYCLES AS MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR, PHARMACEUTICAL COMPOSITIONS THEREOF, THEIR USE IN THE TREATMENT OF CYCSTIC FIBROSIS, AND PROCESS FOR MAKING THEM | Vertex Pharmaceuticals Incorporated (US) | 2020-12-23 | — | — | EP | disclosed |
| WO-2019161078-A1 | MACROCYCLES AS MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR, PHARMACEUTICAL COMPOSITIONS THEREOF, THEIR USE IN THE TREATMENT OF CYCSTIC FIBROSIS, AND PROCESS FOR MAKING THEM | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2019-08-22 | — | — | WO | disclosed |