Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 11/20 | 0.43 |
| ▸ | HTR2A | P28223 | 10/20 | 0.43 |
| ▸ | DRD3 | P35462 | 9/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9014782 | 0.91 | KCNH2 (0.47) | KCNH2DRD2HTR2ADRD3SCN9A | |
| SCHEMBL9014725 | 0.83 | KCNH2 (0.63) | KCNH2DRD2HTR2AHTR1ACCR5 | |
| SCHEMBL9014765 | 0.82 | KCNH2 (0.50) | KCNH2DRD2HTR2ADRD3SCN9A | |
| SCHEMBL9014839 | 0.81 | DRD2 (0.54) | KCNH2DRD2HTR2AHTR1A | |
| SCHEMBL11833053 | 0.79 | SLC18A3 (0.45) | KCNH2DRD2HTR2ADRD3HTR1A | |
| SCHEMBL6792592 | 0.78 | DRD2 (0.52) | KCNH2DRD2HTR2AHTR1ASLC6A4 | |
| SCHEMBL11839176 | 0.77 | DRD2 (0.57) | DRD2HTR2AHTR1A | |
| SCHEMBL6790341 | 0.77 | DRD2 (0.55) | KCNH2DRD2HTR2ADRD3HTR1A | |
| SCHEMBL28752384 | 0.74 | DRD2 (0.55) | KCNH2DRD2HTR2AHTR1A | |
| SCHEMBL9014749 | 0.74 | DRD2 (0.53) | DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5495022-A | Piperidines and piperazines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-02-27 | — | — | US | disclosed |
| EP-0634398-A1 | 4-Phenylpiperidinyl-1/-piperazinyl-1-ethylsubstituted benzofusedheterocycles as antiarrhythmic agents | MERCK PATENT GmbH (DE) | 1995-01-18 | — | — | EP | disclosed |