Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.58 |
| ▸ | IDH1 | O75874 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.34 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.34 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.34 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.34 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13426222 | 0.94 | KCNH2 (0.59) | KCNH2IDH1POLBGSK3BCLK4 | |
| SCHEMBL13425826 | 0.90 | KCNH2 (0.64) | KCNH2IDH1CLK4PIK3C3ALDH1A1 | |
| SCHEMBL13425780 | 0.90 | KCNH2 (0.61) | KCNH2IDH1POLBCLK4ALDH1A1 | |
| SCHEMBL13425745 | 0.88 | KCNH2 (0.60) | KCNH2IDH1POLBCLK4PIK3C3 | |
| SCHEMBL13426219 | 0.87 | KCNH2 (0.58) | KCNH2IDH1CLK4PIK3C3ALDH1A1 | |
| SCHEMBL13425782 | 0.87 | KCNH2 (0.63) | KCNH2IDH1CLK4ALDH1A1CYP1A2 | |
| SCHEMBL3397047 | 0.86 | KCNH2 (0.57) | KCNH2IDH1POLBCLK4PIK3C3 | |
| SCHEMBL13426255 | 0.86 | KCNH2 (0.57) | KCNH2IDH1CLK4PIK3C3ALDH1A1 | |
| SCHEMBL13426231 | 0.86 | KCNH2 (0.56) | KCNH2IDH1PIK3C3MAPK1MET | |
| SCHEMBL13425792 | 0.86 | KCNH2 (0.61) | KCNH2IDH1GSK3BCLK4CCNB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |