Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.69 |
| ▸ | QDPR | P09417 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 6/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.38 |
| ▸ | TLR4 | O00206 | 1/20 | 0.37 |
| ▸ | TLR3 | O15455 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9677908 | 0.94 | KCNH2 (0.77) | KCNH2QDPRTLR9TLR7TLR4 | |
| SCHEMBL9014779 | 0.90 | KCNH2 (0.70) | KCNH2SIGMAR1DRD2 | |
| SCHEMBL9014729 | 0.89 | KCNH2 (0.69) | KCNH2QDPRTLR9TLR7TLR4 | |
| SCHEMBL9014400 | 0.89 | KCNH2 (0.69) | KCNH2QDPRTLR9TLR7TLR4 | |
| SCHEMBL9014359 | 0.88 | KCNH2 (0.89) | KCNH2TLR9TLR7SIGMAR1DRD2 | |
| Fumaric Acid SCHEMBL10407775 | 0.87 | KCNH2 (0.67) | KCNH2QDPRTLR9TLR7PDE4B | |
| Fumaric Acid SCHEMBL10407778 | 0.87 | KCNH2 (0.67) | KCNH2QDPRTLR9TLR7PDE4B | |
| SCHEMBL9014376 | 0.86 | KCNH2 (0.66) | KCNH2TLR9TLR7TLR4TLR3 | |
| SCHEMBL9014391 | 0.83 | KCNH2 (0.65) | KCNH2QDPRTLR9TLR7TLR4 | |
| Hydrochloric Acid SCHEMBL10407809 | 0.82 | KCNH2 (0.76) | KCNH2TLR9TLR7TLR4TLR3 |
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 |