Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.66 |
| ▸ | DRD2 | P14416 | 4/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 8/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.42 |
| ▸ | TLR4 | O00206 | 2/20 | 0.42 |
| ▸ | TLR3 | O15455 | 2/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | QDPR | P09417 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL9014714 | 0.88 | KCNH2 (0.56) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014784 | 0.87 | KCNH2 (0.55) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9231835 | 0.84 | KCNH2 (0.59) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014375 | 0.82 | KCNH2 (0.70) | KCNH2DRD2QDPRSLC6A4 | |
| SCHEMBL9014370 | 0.82 | KCNH2 (0.70) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014339 | 0.81 | PDE4B (0.46) | KCNH2QDPR | |
| SCHEMBL9014688 | 0.80 | KCNH2 (0.67) | KCNH2DRD2DRD4 | |
| SCHEMBL9014780 | 0.80 | KCNH2 (0.66) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014648 | 0.80 | KCNH2 (0.66) | KCNH2DRD2DRD4 | |
| Terikalant SCHEMBL1815992 | 0.80 | KCNH2 (1.00) | KCNH2DRD2TLR9TLR7TLR4 |
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 4 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 | claimed |
| EP-0634398-A1 | 4-Phenylpiperidinyl-1/-piperazinyl-1-ethylsubstituted benzofusedheterocycles as antiarrhythmic agents | MERCK PATENT GmbH (DE) | 1995-01-18 | — | — | EP | claimed |
| 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 |