Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.54 |
| ▸ | CDC7 | O00311 | 3/20 | 0.38 |
| ▸ | EEF2K | O00418 | 1/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 7/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13426790 | 0.87 | KCNH2 (0.57) | KCNH2EEF2KPLK1CLK4CYP1A2 | |
| SCHEMBL13426229 | 0.86 | KCNH2 (0.56) | KCNH2EEF2KPLK1CLK4CYP1A2 | |
| SCHEMBL13425719 | 0.85 | KCNH2 (0.57) | KCNH2CDC7CLK4CYP1A2CYP2C19 | |
| SCHEMBL13425564 | 0.85 | KCNH2 (0.73) | KCNH2CDC7CLK4CYP1A2CYP2C19 | |
| SCHEMBL13425797 | 0.81 | KCNH2 (0.38) | KCNH2CDC7CLK4CYP1A2CYP2C19 | |
| SCHEMBL13426665 | 0.80 | KCNH2 (0.45) | KCNH2CLK4CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL13425540 | 0.79 | KCNH2 (0.51) | KCNH2EEF2KPLK1CLK4CYP1A2 | |
| SCHEMBL13426213 | 0.79 | KCNH2 (0.56) | KCNH2EEF2KPLK1CLK4CYP1A2 | |
| SCHEMBL13426135 | 0.78 | KCNH2 (0.45) | KCNH2EEF2KPLK1CYP1A2CYP2C19 | |
| SCHEMBL3363498 | 0.76 | CLK4 (0.54) | KCNH2CLK4CYP1A2CYP2C19ALDH1A1 |
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 |