Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 6/20 | 0.33 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 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 | |
|---|---|---|---|---|
| SCHEMBL997807 | 0.86 | KCNH2 (0.41) | KCNH2CYP3A4ALOX5 | |
| SCHEMBL21767982 | 0.85 | KCNH2 (0.61) | KCNH2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL1000969 | 0.78 | KCNH2 (0.54) | KCNH2CYP3A4POLBMAPTMEN1 | |
| SCHEMBL998581 | 0.78 | KCNH2 (0.73) | KCNH2CYP3A4ALOX5ADORA1ADORA3 | |
| SCHEMBL1046633 | 0.77 | KCNH2 (0.72) | KCNH2CYP3A4ALOX5ADORA1CSNK1E | |
| SCHEMBL1051312 | 0.77 | KCNH2 (0.72) | KCNH2CYP3A4ALOX5ADORA1CSNK1E | |
| SCHEMBL12952016 | 0.76 | KCNH2 (0.56) | KCNH2CYP3A4ALOX5ADORA1ADORA3 | |
| SCHEMBL1049778 | 0.76 | KCNH2 (0.73) | KCNH2CYP3A4ALOX5CSNK1E | |
| SCHEMBL1051930 | 0.70 | KCNH2 (0.70) | KCNH2CYP3A4ALOX5CSNK1E | |
| SCHEMBL1048320 | 0.70 | KCNH2 (0.70) | KCNH2CYP3A4MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2451814-A2 | FUSED IMIDAZOLES AND COMPOSITIONS COMPRISING THEM FOR THE TREATMENT OF PARASITIC DISEASES, SUCH AS E.G. MALARIA | IRM LLC (BM) | 2012-05-16 | — | — | EP | claimed |
| WO-2011006143-A2 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES | IRM LLC (BM) | 2011-01-13 | — | — | WO | claimed |