Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.49 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | KIT | P10721 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3392272 | 0.90 | KCNH2 (0.54) | KCNH2CDC7MAPK14KITCDK4 | |
| SCHEMBL13425820 | 0.87 | KCNH2 (0.40) | KCNH2MAPK14DYRK1ACDK4CDK2 | |
| SCHEMBL13426043 | 0.86 | KCNH2 (0.43) | KCNH2GSK3AGSK3BCLK4CYP1A2 | |
| SCHEMBL13426803 | 0.86 | CLK4 (0.41) | CLK4CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL3395404 | 0.85 | KCNH2 (0.47) | KCNH2GSK3AGSK3BCLK4CYP1A2 | |
| SCHEMBL13426154 | 0.84 | KCNH2 (0.68) | KCNH2CLK4CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13425737 | 0.83 | KCNH2 (0.46) | KCNH2GSK3AGSK3BCLK4CYP1A2 | |
| SCHEMBL3433175 | 0.83 | KCNH2 (0.47) | KCNH2CLK4CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL3397300 | 0.79 | EIF2AK2 (0.41) | CLK4CDC7MAPK14DYRK1ACDK2 | |
| SCHEMBL13425792 | 0.78 | KCNH2 (0.61) | KCNH2GSK3AGSK3BCLK4CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |