Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | CFTR | P13569 | 12/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL214841 | 0.89 | CNR1 (0.40) | CNR1CFTRCNR2 | |
| SCHEMBL213232 | 0.86 | CNR1 (0.49) | CNR1CFTRCNR2ACVR1ALDH1A1 | |
| SCHEMBL212570 | 0.85 | CNR1 (0.61) | CNR1CFTRCNR2 | |
| SCHEMBL10031414 | 0.85 | CNR1 (0.61) | CNR1CFTRCNR2 | |
| SCHEMBL10031418 | 0.85 | CNR1 (0.61) | CNR1CFTRCNR2 | |
| SCHEMBL3924890 | 0.80 | CNR1 (0.52) | CNR1CNR2 | |
| SCHEMBL3915821 | 0.80 | CNR1 (0.52) | CNR1CNR2 | |
| SCHEMBL213032 | 0.77 | CNR1 (0.44) | CNR1CFTRCNR2 | |
| SCHEMBL215140 | 0.76 | KDM4E (0.45) | ALDH1A1 | |
| SCHEMBL213341 | 0.76 | CNR1 (0.43) | CNR1CFTRCNR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8088920-B2 | 3-trifluoromethyl-pyrazine-2-carboxylic acid amide derivatives as HDL-cholesterol raising agents | HOFFMANN-LA ROCHE INC. (US) | 2012-01-03 | — | — | US | disclosed |
| EP-2271632-A1 | 3-TRIFLUOROMETHYL-PYRAZINE-2-CARBOXYLIC ACID AMIDE DERIVATIVES AS HDL-CHOLESTEROL RAISING AGENTS | F. Hoffmann-La Roche AG (CH) | 2011-01-12 | — | — | EP | disclosed |