Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 9/20 | 0.44 |
| ▸ | DRD4 | P21917 | 6/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 9/20 | 0.40 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | DRD1 | P21728 | 6/20 | 0.39 |
| ▸ | HRH1 | P35367 | 4/20 | 0.39 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 3/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.39 |
| ▸ | HTR2B | P41595 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5559586 | 1.00 | DRD2 (0.44) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL5559580 | 1.00 | DRD2 (0.44) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL5564895 | 0.91 | DRD2 (0.49) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL14511110 | 0.86 | CHRM1 (0.58) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL5562521 | 0.85 | DRD2 (0.39) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL5562518 | 0.85 | DRD2 (0.39) | DRD2DRD4CHRM1DRD3DRD1 | |
| Hydrochloric Acid SCHEMBL5563439 | 0.85 | CHRM1 (0.58) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL14511279 | 0.84 | CHRM1 (0.44) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL5288483 | 0.84 | DRD2 (0.48) | DRD2DRD4CHRM1DRD3DRD1 | |
| SCHEMBL5288472 | 0.84 | DRD2 (0.48) | DRD2DRD4CHRM1DRD3DRD1 |
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-1492794-B1 | PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS | LILLY CO ELI (US) | 2007-12-12 | — | — | EP | disclosed |