Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 20/20 | 0.69 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.69 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.69 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.69 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL2030461 | 0.92 | CFTR (0.72) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL12189155 | 0.90 | CFTR (0.68) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL3671482 | 0.90 | CFTR (0.67) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL12588931 | 0.89 | CFTR (0.71) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL12189042 | 0.89 | CFTR (0.73) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL12189096 | 0.89 | CFTR (0.66) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL14146665 | 0.88 | CFTR (0.75) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL2031497 | 0.88 | CFTR (0.69) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL19594864 | 0.88 | CFTR (0.64) | CFTRNR1I2ADORA3CYP2C8CYP2C9 | |
| SCHEMBL16328539 | 0.86 | CFTR (0.72) | CFTRNR1I2ADORA3CYP2C8CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2789606-B1 | Modulators of CFTR | VERTEX PHARMA (US) | 2017-11-15 | — | — | EP | disclosed |