Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.65 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 6/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.38 |
| ▸ | TLR4 | O00206 | 2/20 | 0.37 |
| ▸ | TLR3 | O15455 | 2/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | QDPR | P09417 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | EED | O75530 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9014647 | 0.92 | KCNH2 (0.68) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014391 | 0.89 | KCNH2 (0.65) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9015278 | 0.89 | KCNH2 (0.65) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9015269 | 0.87 | KCNH2 (0.62) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014416 | 0.86 | KCNH2 (0.61) | KCNH2DRD2QDPR | |
| SCHEMBL9235680 | 0.85 | KCNH2 (0.60) | KCNH2DRD2TLR9TLR7TLR4 | |
| SCHEMBL9014359 | 0.85 | KCNH2 (0.89) | KCNH2DRD2TLR9TLR7NPSR1 | |
| SCHEMBL9014644 | 0.84 | KCNH2 (0.59) | KCNH2DRD2 | |
| SCHEMBL9014779 | 0.80 | KCNH2 (0.70) | KCNH2DRD2 | |
| Terikalant SCHEMBL1815992 | 0.79 | 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 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 |