Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 19/20 | 0.82 |
| ▸ | KCNH2 | Q12809 | 12/20 | 0.82 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10379842 | 0.90 | DGAT1 (0.87) | DGAT1KCNH2SOAT1ADORA2ACYP2C9 | |
| SCHEMBL10382250 | 0.87 | DGAT1 (0.73) | DGAT1KCNH2ADORA2ACYP2C9CYP3A4 | |
| SCHEMBL14235059 | 0.86 | DGAT1 (0.62) | DGAT1KCNH2SOAT1ADORA2A | |
| SCHEMBL10380846 | 0.86 | DGAT1 (0.77) | DGAT1KCNH2ADORA2ACYP2C9CYP3A4 | |
| SCHEMBL10380803 | 0.85 | DGAT1 (0.78) | DGAT1KCNH2SOAT1ADORA2ACYP2C9 | |
| SCHEMBL10381275 | 0.84 | DGAT1 (0.69) | DGAT1KCNH2SOAT1ADORA2ACYP2C9 | |
| SCHEMBL10381276 | 0.81 | DGAT1 (0.67) | DGAT1KCNH2SOAT1CYP2C9CYP3A4 | |
| SCHEMBL10381526 | 0.80 | DGAT1 (0.66) | DGAT1KCNH2ADORA2ACYP2C9CYP3A4 | |
| SCHEMBL10380674 | 0.80 | DGAT1 (0.71) | DGAT1KCNH2SOAT1ADORA2ACYP2C9 | |
| SCHEMBL19175779 | 0.78 | DGAT1 (0.62) | DGAT1KCNH2SOAT1ADORA2A |
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-2012096813-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-07-19 | — | — | WO | disclosed |