Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | HPGD | P15428 | 6/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | GNRHR | P30968 | 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 | |
|---|---|---|---|---|
| SCHEMBL13425597 | 0.90 | KCNH2 (0.50) | KCNH2MAPK1EGLN1CLK4CHEK1 | |
| SCHEMBL13425784 | 0.90 | KCNH2 (0.52) | KCNH2KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL13426244 | 0.88 | KCNH2 (0.50) | KCNH2MAPK1LMNACYP1A2CYP3A4 | |
| SCHEMBL13425751 | 0.88 | KCNH2 (0.51) | KCNH2ALDH1A1MAPK1LMNAHSD17B10 | |
| SCHEMBL13425632 | 0.86 | KCNH2 (0.49) | KCNH2MAPK1EGLN1CLK4 | |
| SCHEMBL13425609 | 0.85 | KCNH2 (0.49) | KCNH2KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL13426216 | 0.85 | KCNH2 (0.48) | KCNH2MAPK1EGLN1CYP2D6CLK4 | |
| SCHEMBL3399224 | 0.84 | KCNH2 (0.47) | KCNH2KDM4EALDH1A1MAPK1MAPT | |
| SCHEMBL13426311 | 0.84 | KCNH2 (0.47) | KCNH2RAB9AHTTNPC1SMN1; SMN2 | |
| SCHEMBL13425790 | 0.82 | KCNH2 (0.56) | KCNH2KDM4EALDH1A1HPGDMAPK1 |
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 |