Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 3/20 | 0.42 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.35 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.35 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.35 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14201644 | 0.90 | AQP1 (0.39) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL14201639 | 0.88 | AQP1 (0.41) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL14201642 | 0.86 | AQP1 (0.42) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL8225710 | 0.86 | AQP1 (0.45) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL8220835 | 0.85 | AQP1 (0.40) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL8225938 | 0.85 | AQP1 (0.50) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL14202297 | 0.84 | PRKAB2 (0.36) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL8241414 | 0.83 | AQP1 (0.61) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL5361392 | 0.81 | AQP1 (0.51) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL5361397 | 0.81 | AQP1 (0.51) | AQP1PRKAB2PRKAG1PRKAA2PRKAA1 |
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-2008052086-A1 | BENZODIOXANE DERIVATIVES AND USES THEREOF | WYETH (US) | 2008-05-02 | — | — | WO | disclosed |