Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.59 |
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 9/20 | 0.46 |
| ▸ | QDPR | P09417 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9014334 | 0.89 | KCNH2 (0.46) | KCNH2PDE4BQDPR | |
| SCHEMBL9014422 | 0.83 | FFAR1 (0.48) | KCNH2PTGDR2 | |
| SCHEMBL9014711 | 0.82 | PTGDR2 (0.51) | KCNH2PTGDR2PDE4BQDPR | |
| SCHEMBL9014406 | 0.81 | KCNH2 (0.83) | KCNH2QDPR | |
| SCHEMBL9014710 | 0.80 | PTGDR2 (0.52) | PTGDR2PDE4BQDPR | |
| SCHEMBL9014339 | 0.80 | PDE4B (0.46) | KCNH2PDE4BQDPR | |
| SCHEMBL9233397 | 0.75 | ADAM17 (0.47) | KCNH2PDE4BQDPR | |
| Terikalant SCHEMBL1815992 | 0.74 | KCNH2 (1.00) | KCNH2QDPR | |
| Terikalant SCHEMBL30770792 | 0.74 | KCNH2 (1.00) | KCNH2QDPR | |
| Terikalant SCHEMBL9678648 | 0.74 | KCNH2 (1.00) | KCNH2QDPR |
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 |