Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.41 |
| ▸ | CCR3 | P51677 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | TBK1 | Q9UHD2 | 5/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.36 |
| ▸ | GPR6 | P46095 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3079710 | 1.00 | HRH1 (0.41) | HRH1CCR3KCNH2DRD2SLC6A4 | |
| SCHEMBL3079707 | 0.88 | HRH1 (0.44) | HRH1CCR3KCNH2DRD2SLC6A4 | |
| SCHEMBL14715627 | 0.88 | HRH1 (0.44) | HRH1CCR3KCNH2DRD2SLC6A4 | |
| SCHEMBL3960280 | 0.87 | FPR2 (0.47) | HRH1CCR3KCNH2DRD2SLC6A4 | |
| SCHEMBL14715698 | 0.87 | FPR2 (0.47) | HRH1CCR3KCNH2DRD2SLC6A4 | |
| SCHEMBL3963467 | 0.87 | HRH1 (0.43) | HRH1CCR3KCNH2DRD2SLC6A4 | |
| SCHEMBL14715616 | 0.87 | MEN1 (0.43) | HRH1KCNH2DRD2HRH3GPR6 | |
| SCHEMBL14715640 | 0.87 | MEN1 (0.43) | HRH1KCNH2DRD2HRH3GPR6 | |
| Hydrochloric Acid SCHEMBL3074547 | 0.86 | FPR2 (0.46) | HRH1CCR3KCNH2DRD2TBK1 | |
| Hydrochloric Acid SCHEMBL3074546 | 0.86 | FPR2 (0.46) | HRH1CCR3KCNH2DRD2TBK1 |
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-2079693-B1 | ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | HOFFMANN LA ROCHE (CH) | 2013-02-27 | — | — | EP | claimed |
| US-7795437-B2 | Ether derivatives | HOFFMANN-LA ROCHE INC. (US) | 2010-09-14 | — | — | US | disclosed |