Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 15/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27825513 | 0.96 | CFTR (0.45) | CFTRMCHR1TP53 | |
| SCHEMBL27977473 | 0.93 | CFTR (0.48) | CFTRTP53 | |
| SCHEMBL27825584 | 0.92 | CFTR (0.48) | CFTRTP53 | |
| SCHEMBL27825466 | 0.92 | TP53 (0.48) | CFTRTP53 | |
| SCHEMBL27825498 | 0.88 | CFTR (0.44) | CFTRMCHR1TP53 | |
| SCHEMBL4118830 | 0.87 | CFTR (0.46) | CFTRTP53 | |
| SCHEMBL12027072 | 0.86 | CFTR (0.56) | CFTR | |
| SCHEMBL28814456 | 0.85 | CFTR (0.43) | CFTRMCHR1 | |
| SCHEMBL27977472 | 0.85 | CFTR (0.43) | CFTRMCHR1 | |
| SCHEMBL27804848 | 0.85 | CFTR (0.52) | 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 |
|---|---|---|---|---|---|---|---|
| CN-103951614-A | Pyridyl derivatives as CFTR modulators | VERTEX PHARMA | 2014-07-30 | — | — | CN | disclosed |
| CN-101981011-A | Pyridyl derivatives as CFTR modulators | VERTEX PHARMA | 2011-02-23 | — | — | CN | disclosed |