Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 14/20 | 0.78 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.72 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.54 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.51 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.51 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.50 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.50 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.50 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA4 | P22748 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | FABP1 | P07148 | 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 | |
|---|---|---|---|---|
| SCHEMBL10113371 | 0.95 | DGAT1 (0.81) | DGAT1SOAT1CYP3A4KCNH2MCHR1 | |
| SCHEMBL10113449 | 0.95 | DGAT1 (0.87) | DGAT1SOAT1CYP3A4KCNH2MCHR1 | |
| SCHEMBL10113443 | 0.90 | DGAT1 (0.90) | DGAT1SOAT1CYP3A4SOAT2DGAT2 | |
| SCHEMBL10113429 | 0.85 | DGAT1 (0.91) | DGAT1SOAT1CYP3A4SOAT2DGAT2 | |
| SCHEMBL10113679 | 0.84 | DGAT1 (1.00) | DGAT1SOAT1CYP3A4SOAT2DGAT2 | |
| SCHEMBL10113657 | 0.84 | DGAT1 (0.86) | DGAT1SOAT1CYP3A4KCNH2MCHR1 | |
| SCHEMBL10113358 | 0.84 | DGAT1 (0.80) | DGAT1SOAT1CYP3A4KCNH2MCHR1 | |
| SCHEMBL10113364 | 0.84 | DGAT1 (0.92) | DGAT1SOAT1CYP3A4SOAT2DGAT2 | |
| SCHEMBL10113663 | 0.83 | DGAT1 (0.76) | DGAT1SOAT1CYP3A4KCNH2MCHR1 | |
| SCHEMBL10113434 | 0.83 | DGAT1 (0.91) | DGAT1SOAT1CYP3A4SOAT2DGAT2 |
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-2012024179-A1 | SUBSTITUTED AMIDE DERIVATIVES AS DGAT-1 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-02-23 | — | — | WO | disclosed |