Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 20/20 | 0.63 |
| ▸ | SOAT1 | P35610 | 7/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 16/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL902206 | 0.80 | DGAT1 (0.61) | DGAT1SOAT1KCNH2 | |
| SCHEMBL10189566 | 0.78 | DGAT1 (0.77) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL902557 | 0.77 | DGAT1 (0.86) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL900479 | 0.76 | CHEK2 (0.52) | DGAT1SOAT1 | |
| SCHEMBL10189200 | 0.76 | DGAT1 (0.71) | DGAT1SOAT1KCNH2ADORA2ACYP2C8 | |
| SCHEMBL901747 | 0.73 | DGAT1 (0.70) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL14971910 | 0.73 | DGAT1 (1.00) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL10189107 | 0.70 | DGAT1 (0.86) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL4183736 | 0.69 | CBFB (0.81) | — | |
| SCHEMBL14969301 | 0.68 | DGAT1 (0.76) | DGAT1SOAT1KCNH2ADORA2A |
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-2012044567-A2 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |