Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 17/20 | 0.64 |
| ▸ | DRD1 | P21728 | 11/20 | 0.64 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.64 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.64 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.64 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.64 |
| ▸ | MTOR | P42345 | 1/20 | 0.64 |
| ▸ | DRD3 | P35462 | 3/20 | 0.58 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.58 |
| ▸ | DRD5 | P21918 | 2/20 | 0.58 |
| ▸ | HRH1 | P35367 | 2/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.58 |
| ▸ | DRD4 | P21917 | 2/20 | 0.58 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL5556973 | 1.00 | DRD2 (0.64) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| SCHEMBL14511284 | 0.84 | DRD2 (0.72) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| SCHEMBL3414150 | 0.84 | DRD2 (0.72) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| SCHEMBL3408973 | 0.83 | DRD2 (0.68) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| N-Desmethylclozapine SCHEMBL30416482 | 0.79 | DRD2 (1.00) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| N-Desmethylclozapine SCHEMBL29365906 | 0.79 | DRD2 (1.00) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| N-Desmethylclozapine SCHEMBL781423 | 0.79 | DRD2 (1.00) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| N-Desmethylclozapine SCHEMBL29360816 | 0.79 | DRD2 (1.00) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| SCHEMBL20887469 | 0.79 | DRD2 (0.88) | DRD2DRD1CHRM1CYP1A2CHRM2 | |
| SCHEMBL3409655 | 0.79 | DRD2 (0.67) | DRD2DRD1CHRM1CYP1A2CHRM2 |
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-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 |
| US-7214673-B2 | For therapy of psychosis and bipolar disorder | ELI LILLY AND COMPANY (US) | 2007-05-08 | — | — | US | disclosed |