Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8564169 | 0.78 | KCNH2 (0.72) | KCNJ1KCNH2HRH3L3MBTL3L3MBTL1 | |
| SCHEMBL8352698 | 0.69 | L3MBTL1 (0.60) | HRH3L3MBTL3L3MBTL1SIGMAR1 | |
| SCHEMBL8565829 | 0.69 | SIGMAR1 (0.51) | HRH3L3MBTL3L3MBTL1SIGMAR1 | |
| SCHEMBL8913567 | 0.67 | KCNJ1 (0.68) | KCNJ1KCNH2HRH3SIGMAR1 | |
| SCHEMBL13958511 | 0.66 | HRH3 (0.70) | HRH3L3MBTL3L3MBTL1SIGMAR1 | |
| SCHEMBL5023614 | 0.63 | HRH3 (0.65) | KCNJ1KCNH2HRH3SIGMAR1 | |
| SCHEMBL3951350 | 0.59 | HRH3 (0.58) | HRH3SIGMAR1 | |
| SCHEMBL8568229 | 0.59 | SIGMAR1 (0.57) | SIGMAR1 | |
| SCHEMBL8562251 | 0.59 | KCNH2 (0.78) | KCNJ1KCNH2SIGMAR1 | |
| SCHEMBL3780476 | 0.58 | HRH3 (0.56) | HRH3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0431943-B1 | Spiro(pyran)piperidine derivatives | MERCK & CO INC (US) | 1998-07-15 | — | — | EP | disclosed |
| US-5633247-A | ANTIARRTHYMIA AGENT | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5206240-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1993-04-27 | — | — | US | disclosed |
| EP-0431943-A2 | Nitrogen-containing spirocycles | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |