Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 9/20 | 0.82 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.82 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 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 | |
|---|---|---|---|---|
| SCHEMBL13256552 | 0.91 | KCNA5 (0.84) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL3621068 | 0.90 | KCNA5 (1.00) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL3623960 | 0.89 | KCNA5 (0.89) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL3618762 | 0.86 | KCNA5 (0.76) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL3623444 | 0.86 | KCNA5 (0.76) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL3623049 | 0.86 | KCNA5 (0.74) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL3122092 | 0.85 | KCNA5 (0.75) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL1384172 | 0.85 | KCNA5 (0.78) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL1383496 | 0.85 | KCNA5 (0.83) | KCNA5KCNH2DPP4HPGDMAPK1 | |
| SCHEMBL1381032 | 0.85 | KCNA5 (0.74) | KCNA5KCNH2DPP4HPGDMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-4824563-B2 | — | — | 2011-11-30 | — | — | JP | claimed |
| EP-1667981-A4 | ISOQUINOLINE POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2008-08-13 | — | — | EP | claimed |
| EP-1667981-A1 | ISOQUINOLINE POTASSIUM CHANNEL INHIBITORS | Merck & Co., Inc. (US) | 2006-06-14 | — | — | EP | claimed |
| WO-2005030729-A1 | ISOQUINOLINE POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2005-04-07 | — | — | WO | claimed |