Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.74 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL13426284 | 0.90 | KCNH2 (0.59) | KCNH2TGFBR1CHEK1CYP1A2CLK4 | |
| SCHEMBL13426154 | 0.89 | KCNH2 (0.68) | KCNH2CHEK1CYP1A2CLK4CYP3A4 | |
| SCHEMBL3393337 | 0.89 | KCNH2 (0.58) | KCNH2TGFBR1CHEK1CYP1A2CLK4 | |
| SCHEMBL13425745 | 0.88 | KCNH2 (0.60) | KCNH2CYP1A2CLK4CYP3A4ALDH1A1 | |
| SCHEMBL3397584 | 0.87 | KCNH2 (0.59) | KCNH2WNT3ACYP1A2CLK4CYP3A4 | |
| SCHEMBL13425792 | 0.87 | KCNH2 (0.61) | KCNH2CYP1A2CLK4CYP3A4ALDH1A1 | |
| SCHEMBL13425762 | 0.87 | KCNH2 (0.61) | KCNH2CYP1A2CLK4CYP3A4ALDH1A1 | |
| SCHEMBL3432958 | 0.86 | KCNH2 (0.60) | KCNH2CYP1A2CLK4CYP3A4ALDH1A1 | |
| SCHEMBL3396134 | 0.86 | KCNH2 (0.56) | KCNH2CYP1A2CLK4CYP3A4ALDH1A1 | |
| SCHEMBL3397047 | 0.86 | KCNH2 (0.57) | KCNH2CYP1A2CLK4CYP3A4ALDH1A1 |
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 |