Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 6/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.43 |
| ▸ | DGAT2 | Q96PD7 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL884457 | 0.87 | KCNA5 (0.51) | KCNA5KCNH2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL884569 | 0.86 | KCNA5 (0.51) | KCNA5KCNH2ALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL5030913 | 0.85 | KCNA5 (0.51) | KCNA5KCNH2CLK4PDE4BLMNA | |
| SCHEMBL885203 | 0.84 | KCNA5 (0.42) | KCNA5KCNH2ALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL5038360 | 0.84 | KCNA5 (0.48) | KCNA5KCNH2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL2064429 | 0.83 | KCNA5 (0.69) | KCNA5KCNH2DGAT2RPS6KA3 | |
| SCHEMBL5033715 | 0.83 | KCNA5 (0.50) | KCNA5KCNH2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL884817 | 0.82 | PDE4A (0.46) | KCNA5KCNH2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL884639 | 0.82 | KCNA5 (0.45) | KCNA5KCNH2CYP3A4HSD17B10LMNA | |
| SCHEMBL884449 | 0.81 | KCNA5 (0.44) | KCNA5KCNH2CYP3A4ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1940406-A2 | POTASSIUM CHANNEL INHIBITORS | Merck and Co., Inc. (US) | 2008-07-09 | — | — | EP | claimed |
| WO-2007050348-A2 | POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2007-05-03 | — | — | WO | claimed |