Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 9/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | DHODH | Q02127 | 10/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14972246 | 0.90 | DGAT1 (0.53) | DGAT1ADORA2ADHODHKCNH2PARP1 | |
| SCHEMBL14972239 | 0.85 | DGAT1 (0.47) | DGAT1ADORA2ADHODHKCNH2 | |
| SCHEMBL14972233 | 0.85 | DGAT1 (0.45) | DGAT1ADORA2ADHODHKCNH2PARP1 | |
| SCHEMBL14969110 | 0.83 | DGAT1 (0.49) | DGAT1ADORA2ADHODHKCNH2 | |
| SCHEMBL14972249 | 0.83 | DGAT1 (0.49) | DGAT1ADORA2ADHODHKCNH2 | |
| SCHEMBL14972251 | 0.82 | DGAT1 (0.53) | DGAT1ADORA2ADHODHKCNH2 | |
| SCHEMBL14971920 | 0.82 | DHODH (0.51) | DGAT1ADORA2ADHODHKCNH2PARP1 | |
| SCHEMBL14972256 | 0.81 | DGAT1 (0.49) | DGAT1ADORA2ADHODHKCNH2 | |
| SCHEMBL14971563 | 0.81 | DGAT1 (0.47) | DGAT1ADORA2ADHODHKCNH2 | |
| SCHEMBL14971609 | 0.81 | DGAT1 (0.47) | DGAT1ADORA2ADHODHKCNH2 |
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 |