Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.65 |
| ▸ | DRD2 | P14416 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.39 |
| ▸ | TLR4 | O00206 | 1/20 | 0.39 |
| ▸ | TLR3 | O15455 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | QDPR | P09417 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9014779 | 0.89 | KCNH2 (0.70) | KCNH2DRD2ENPP2DRD4 | |
| SCHEMBL9014406 | 0.88 | KCNH2 (0.83) | KCNH2DRD2CYP3A4TLR9TLR7 | |
| SCHEMBL9014334 | 0.82 | KCNH2 (0.46) | KCNH2CYP3A4MEN1MAPTKMT2A | |
| SCHEMBL9677908 | 0.80 | KCNH2 (0.77) | KCNH2DRD2SMN1; SMN2TLR9TLR7 | |
| Hydrochloric Acid SCHEMBL10407809 | 0.80 | KCNH2 (0.76) | KCNH2DRD2HTR1ATLR9TLR7 | |
| SCHEMBL9014758 | 0.79 | KCNH2 (0.69) | KCNH2DRD2SMN1; SMN2TLR9TLR7 | |
| SCHEMBL9014400 | 0.79 | KCNH2 (0.69) | KCNH2DRD2CYP3A4MEN1KMT2A | |
| SCHEMBL9014729 | 0.79 | KCNH2 (0.69) | KCNH2DRD2MEN1KMT2ATLR9 | |
| Terikalant SCHEMBL30770792 | 0.79 | KCNH2 (1.00) | KCNH2DRD2SLC6A4TLR9TLR7 | |
| Terikalant SCHEMBL1815992 | 0.79 | KCNH2 (1.00) | KCNH2DRD2SLC6A4TLR9TLR7 |
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 |