Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 9/20 | 0.46 |
| ▸ | HTR2A | P28223 | 8/20 | 0.46 |
| ▸ | TBK1 | Q9UHD2 | 8/20 | 0.43 |
| ▸ | IKBKE | Q14164 | 5/20 | 0.43 |
| ▸ | DRD2 | P14416 | 6/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3083241 | 0.90 | DRD3 (0.57) | DRD3HTR2ADRD2 | |
| SCHEMBL14715621 | 0.87 | HTR2A (0.47) | DRD3HTR2ADRD2HTR1A | |
| SCHEMBL3963444 | 0.87 | DRD2 (0.56) | DRD3HTR2ADRD2HTR1A | |
| SCHEMBL3075427 | 0.87 | DRD2 (0.56) | DRD3HTR2ADRD2HTR1A | |
| SCHEMBL3067525 | 0.86 | DRD3 (0.53) | DRD3HTR2ADRD2 | |
| SCHEMBL3078178 | 0.86 | DRD3 (0.53) | DRD3HTR2ADRD2 | |
| SCHEMBL3091198 | 0.85 | DRD3 (0.47) | DRD3HTR2ADRD2HTR1A | |
| SCHEMBL3083297 | 0.85 | DRD3 (0.47) | DRD3HTR2ADRD2HTR1A | |
| SCHEMBL3080661 | 0.85 | DRD3 (0.49) | DRD3HTR2ADRD2 | |
| SCHEMBL14715609 | 0.85 | HRH1 (0.45) | DRD3HTR2ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2079693-B1 | ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | HOFFMANN LA ROCHE (CH) | 2013-02-27 | — | — | EP | claimed |