Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGAV | P06756 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.34 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13425751 | 0.93 | KCNH2 (0.51) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL13425597 | 0.92 | KCNH2 (0.50) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL13425632 | 0.91 | KCNH2 (0.49) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL13425609 | 0.90 | KCNH2 (0.49) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL3399662 | 0.90 | KCNH2 (0.51) | KCNH2MAPK1CLK4CHEK1KDM4E | |
| SCHEMBL13426216 | 0.90 | KCNH2 (0.48) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL3399224 | 0.89 | KCNH2 (0.47) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL13426244 | 0.89 | KCNH2 (0.50) | KCNH2MAPK1HRH2HRH1DYRK1A | |
| SCHEMBL13426311 | 0.88 | KCNH2 (0.47) | KCNH2CHEK1LRRK2 | |
| SCHEMBL13425790 | 0.87 | KCNH2 (0.56) | KCNH2MAPK1HRH2HRH1DYRK1A |
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 |