Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 13/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.53 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.44 |
| ▸ | DHODH | Q02127 | 4/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL14972233 | 0.92 | DGAT1 (0.45) | DGAT1KCNH2DHODHADORA2AAMY1A | |
| SCHEMBL14972256 | 0.90 | DGAT1 (0.49) | DGAT1KCNH2SOAT1DHODHADORA2A | |
| SCHEMBL14971853 | 0.89 | DGAT1 (0.52) | DGAT1KCNH2SOAT1DHODHADORA2A | |
| SCHEMBL14969110 | 0.88 | DGAT1 (0.49) | DGAT1KCNH2DHODHADORA2AMKNK1 | |
| SCHEMBL14972249 | 0.88 | DGAT1 (0.49) | DGAT1KCNH2DHODHADORA2AMKNK1 | |
| SCHEMBL14969219 | 0.88 | DGAT1 (0.47) | DGAT1KCNH2SOAT1DHODHADORA2A | |
| SCHEMBL14971563 | 0.88 | DGAT1 (0.47) | DGAT1KCNH2SOAT1DHODHADORA2A | |
| SCHEMBL14971609 | 0.88 | DGAT1 (0.47) | DGAT1KCNH2SOAT1DHODHADORA2A | |
| SCHEMBL14972239 | 0.87 | DGAT1 (0.47) | DGAT1KCNH2SOAT1DHODHADORA2A | |
| SCHEMBL14972175 | 0.84 | DGAT1 (0.75) | DGAT1KCNH2SOAT1ADORA2AAMY1A |
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-2013074387-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2013-05-23 | — | — | WO | disclosed |