Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 3/20 | 0.60 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.47 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.38 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.38 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.38 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.38 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.38 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.38 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.34 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4231239 | 0.92 | AQP1 (0.58) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4218913 | 0.88 | AQP1 (0.54) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4220623 | 0.88 | AQP1 (0.54) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4231164 | 0.84 | AQP1 (0.57) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL27707638 | 0.83 | AQP1 (0.47) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4232174 | 0.82 | AQP1 (0.67) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4230508 | 0.82 | AQP1 (0.61) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4225480 | 0.81 | AQP1 (0.65) | AQP1EZH2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4225947 | 0.81 | AQP1 (0.67) | AQP1EZH2HTR2ACHRM1SLC6A2 | |
| SCHEMBL27703101 | 0.81 | AQP1 (0.53) | AQP1EZH2CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101203216-A | Dihydrobenzofuran derivatives and uses thereof | WYETH CORP (US) | 2008-06-18 | — | — | CN | disclosed |
| EP-1871355-A1 | NEW THERAPEUTIC COMBIANATIONS FOR THE TREATMENT OR PREVENTION OF DEPRESSION | Wyeth (US) | 2008-01-02 | — | — | EP | disclosed |
| WO-2006116149-A1 | NEW THERAPEUTIC COMBIANATIONS FOR THE TREATMENT OR PREVENTION OF DEPRESSION | WYETH (US) | 2006-11-02 | — | — | WO | disclosed |