Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393631 | 0.91 | KCNH2 (0.54) | KCNH2ALDH1A1KDM4EMAPTGAA | |
| SCHEMBL13425762 | 0.89 | KCNH2 (0.61) | KCNH2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL13426154 | 0.86 | KCNH2 (0.68) | KCNH2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL3395952 | 0.86 | KCNH2 (0.56) | KCNH2ALDH1A1MAPTGAALMNA | |
| SCHEMBL13425607 | 0.85 | KCNH2 (0.58) | KCNH2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL3397756 | 0.85 | KCNH2 (0.58) | KCNH2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL3427229 | 0.85 | KCNH2 (0.58) | KCNH2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL13425782 | 0.85 | KCNH2 (0.63) | KCNH2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL13425748 | 0.85 | KCNH2 (0.53) | KCNH2MAPTLMNAL3MBTL1 | |
| SCHEMBL13425792 | 0.84 | KCNH2 (0.61) | KCNH2ALDH1A1KDM4ELMNACLK4 |
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 |