Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 3/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.33 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.33 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.33 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.33 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.33 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.33 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4965176 | 0.88 | AQP1 (0.41) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4837073 | 0.88 | AQP1 (0.44) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4969988 | 0.85 | AQP1 (0.46) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4231836 | 0.84 | AQP1 (0.42) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4788915 | 0.84 | AQP1 (0.53) | AQP1HTR2AHTR2CHRH1 | |
| SCHEMBL5141127 | 0.84 | AQP1 (0.41) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4830417 | 0.84 | AQP1 (0.65) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4966046 | 0.81 | AQP1 (0.48) | AQP1HTR2APRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4831359 | 0.81 | AQP1 (0.39) | AQP1 | |
| SCHEMBL4368891 | 0.81 | AQP1 (0.48) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1879569-A2 | THERAPEUTIC COMBINATIONS FOR THE TREATMENT OR PREVENTION OF PSYCHOTIC DISORDERS | Wyeth (US) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006116221-A2 | THERAPEUTIC COMBINATIONS FOR THE TREATMENT OR PREVENTION OF PSYCHOTIC DISORDERS | WYETH (US) | 2006-11-02 | — | — | WO | disclosed |