Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9014394 | 0.85 | KCNH2 (0.64) | KCNH2DRD2HTR2AMAPK1CCR5 | |
| SCHEMBL9014667 | 0.85 | SIGMAR1 (0.61) | KCNH2SIGMAR1ABCB1 | |
| SCHEMBL9014741 | 0.84 | KCNH2 (0.56) | KCNH2SIGMAR1ABCB1 | |
| SCHEMBL9014688 | 0.83 | KCNH2 (0.67) | KCNH2DRD2SIGMAR1 | |
| SCHEMBL10407581 | 0.81 | KCNH2 (0.71) | KCNH2DRD2HTR2AMAPK1CCR5 | |
| Hydrochloric Acid SCHEMBL10407829 | 0.81 | KCNH2 (0.70) | KCNH2DRD2HTR2AMAPK1CCR5 | |
| SCHEMBL9014648 | 0.80 | KCNH2 (0.66) | KCNH2DRD2SIGMAR1 | |
| SCHEMBL9014375 | 0.77 | KCNH2 (0.70) | KCNH2DRD2SIGMAR1 | |
| SCHEMBL9235680 | 0.74 | KCNH2 (0.60) | KCNH2DRD2HTR2AMAPK1CCR5 | |
| SCHEMBL9014359 | 0.71 | KCNH2 (0.89) | KCNH2DRD2SIGMAR1 |
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 |