Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 11/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.69 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.55 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | TIPARP | Q7Z3E1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15054936 | 1.00 | DGAT1 (0.69) | DGAT1KCNH2ADORA2APANK3CHRM4 | |
| SCHEMBL15054893 | 1.00 | DGAT1 (0.69) | DGAT1KCNH2ADORA2APANK3CHRM4 | |
| SCHEMBL13622620 | 0.90 | KCNH2 (0.55) | DGAT1KCNH2PANK3CHRM4GPR119 | |
| SCHEMBL5212878 | 0.84 | PANK3 (0.51) | DGAT1KCNH2PANK3CHRM4GPR119 | |
| Trifluoroacetic Acid SCHEMBL1023392 | 0.83 | DPP4 (0.56) | DGAT1KCNH2PANK3CHRM4GPR119 | |
| SCHEMBL14127751 | 0.83 | DGAT1 (0.61) | DGAT1KCNH2ADORA2A | |
| SCHEMBL14127679 | 0.83 | DGAT1 (0.61) | DGAT1KCNH2ADORA2A | |
| SCHEMBL14127680 | 0.83 | DGAT1 (0.61) | DGAT1KCNH2ADORA2A | |
| SCHEMBL15626652 | 0.82 | DGAT1 (0.88) | DGAT1KCNH2ADORA2A | |
| SCHEMBL15626556 | 0.82 | DGAT1 (0.88) | DGAT1KCNH2ADORA2A |
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-2013096093-A1 | COMPOUNDS AS DGAT-1 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2013-06-27 | — | — | WO | disclosed |