Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB2 | P30411 | 8/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.68 |
| ▸ | RORC | P51449 | 11/20 | 0.42 |
| ▸ | CD38 | P28907 | 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 | |
|---|---|---|---|---|
| SCHEMBL12711997 | 0.93 | BDKRB2 (0.63) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL13448521 | 0.88 | BDKRB2 (0.57) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL12712317 | 0.86 | BDKRB2 (0.68) | BDKRB2CYP3A4CYP2C19RORCCD38 | |
| SCHEMBL13146157 | 0.85 | BDKRB2 (0.74) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL12711953 | 0.85 | BDKRB2 (0.71) | BDKRB2CYP3A4CYP2C19RORCCD38 | |
| SCHEMBL12711973 | 0.84 | BDKRB2 (0.82) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL1563916 | 0.84 | BDKRB2 (0.80) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL13146203 | 0.84 | BDKRB2 (0.73) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL13145949 | 0.83 | BDKRB2 (0.79) | BDKRB2CYP3A4CYP2C19RORC | |
| SCHEMBL12712293 | 0.83 | BDKRB2 (0.77) | BDKRB2CYP3A4CYP2C19RORC |
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-2144897-B1 | 8-OXY-QUINOLINE DERIVATIVES AS BRADYKININ B2 RECEPTOR MODULATORS | JERINI AG (DE) | 2010-10-20 | — | — | EP | disclosed |
| WO-2008116620-A1 | 8-OXY-QUINOLINE DERIVATIVES AS BRADYKININ B2 RECEPTOR MODULATORS | JERINI AG (DE) | 2008-10-02 | — | — | WO | disclosed |