Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.65 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.41 |
| ▸ | TLR4 | O00206 | 2/20 | 0.41 |
| ▸ | TLR3 | O15455 | 2/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | QDPR | P09417 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9014370 | 0.88 | KCNH2 (0.70) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014780 | 0.85 | KCNH2 (0.66) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014719 | 0.84 | SIGMAR1 (0.52) | KCNH2DRD2 | |
| SCHEMBL9014725 | 0.82 | KCNH2 (0.63) | KCNH2DRD2HTR2CQDPR | |
| SCHEMBL9014707 | 0.82 | DRD2 (0.52) | KCNH2DRD2 | |
| SCHEMBL9014765 | 0.82 | KCNH2 (0.50) | KCNH2DRD2TLR9TLR7 | |
| SCHEMBL9014375 | 0.81 | KCNH2 (0.70) | KCNH2DRD2HTR2CQDPR | |
| SCHEMBL9014708 | 0.81 | KCNH2 (0.61) | KCNH2DRD2HTR2CQDPR | |
| SCHEMBL9014688 | 0.80 | KCNH2 (0.67) | KCNH2DRD2 | |
| SCHEMBL9014648 | 0.79 | KCNH2 (0.66) | KCNH2DRD2 |
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 |