Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.48 |
| ▸ | KCNJ1 | P48048 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8565646 | 0.84 | KCNJ1 (0.43) | KCNH2KCNJ1ALDH1A1ALOX15TSHR | |
| SCHEMBL5654900 | 0.79 | MEN1 (0.37) | ALDH1A1ALOX15TSHRMAPK1HSD17B10 | |
| SCHEMBL3258334 | 0.76 | CA2 (0.50) | KCNH2ALDH1A1ALOX15TSHRKDM4E | |
| SCHEMBL8190246 | 0.73 | KCNJ1 (0.59) | KCNH2KCNJ1ALDH1A1ALOX15TSHR | |
| SCHEMBL8570176 | 0.72 | ALDH1A1 (0.43) | ALDH1A1PKMKDM4E | |
| SCHEMBL17444566 | 0.72 | DAO (0.48) | KCNH2ALDH1A1ALOX15TSHRHSD17B10 | |
| SCHEMBL1431818 | 0.71 | PNMT (0.47) | KCNH2ALDH1A1ALOX15TSHR | |
| SCHEMBL5344844 | 0.71 | DAO (0.40) | KCNH2ALDH1A1ALOX15TSHRKDM4E | |
| SCHEMBL24425019 | 0.70 | KCNJ1 (0.56) | KCNH2KCNJ1ALDH1A1ALOX15TSHR | |
| SCHEMBL2959929 | 0.70 | CA2 (0.55) | ALDH1A1KDM4E |
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 7 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 |
| US-5112824-A | Benzofurazan compounds | MERCK & CO., INC. (US) | 1992-05-12 | — | — | US | disclosed |
| US-5032604-A | Class III antiarrhythmic agents | MERCK & CO., INC. (US) | 1991-07-16 | — | — | US | disclosed |
| EP-0431944-A2 | Benzofurazan derivatives having antiarrhythmic properties | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |
| EP-0431943-A2 | Nitrogen-containing spirocycles | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |