Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.32 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1377889 | 0.93 | KCNA5 (0.36) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3819751 | 0.89 | CYP1A2 (0.35) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1382631 | 0.89 | CYP1A2 (0.37) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1380492 | 0.85 | KIF11 (0.35) | CYP3A4BACE1 | |
| SCHEMBL3814663 | 0.84 | BACE1 (0.33) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1377502 | 0.82 | KCNH3 (0.39) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1378529 | 0.82 | APP (0.37) | CYP3A4BACE1APPKCNH2 | |
| SCHEMBL1381592 | 0.81 | CYP19A1 (0.41) | CYP3A4 | |
| SCHEMBL1378654 | 0.74 | CYP3A4 (0.39) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3813876 | 0.72 | CYP1A2 (0.35) | KCNA5CYP1A2CYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| JP-4719744-B2 | — | — | 2011-07-06 | — | — | JP | claimed |
| EP-1776355-A4 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2009-08-12 | — | — | EP | claimed |
| EP-1776355-A2 | POTASSIUM CHANNEL INHIBITORS | Merck & Co., Inc. (US) | 2007-04-25 | — | — | EP | claimed |
| WO-2006014877-A2 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | claimed |
| EP-1776355-A4 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2009-08-12 | — | — | EP | disclosed |
| EP-1776355-A2 | POTASSIUM CHANNEL INHIBITORS | Merck & Co., Inc. (US) | 2007-04-25 | — | — | EP | disclosed |
| WO-2006014877-A2 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | disclosed |