Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB1 | P46663 | 19/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL3535022 | 0.87 | BDKRB1 (0.58) | BDKRB1 | |
| SCHEMBL3537190 | 0.85 | BDKRB1 (0.60) | BDKRB1 | |
| SCHEMBL3537196 | 0.85 | BDKRB1 (0.60) | BDKRB1 | |
| SCHEMBL3532763 | 0.85 | BDKRB1 (0.55) | BDKRB1ALDH1A1 | |
| SCHEMBL3533192 | 0.85 | BDKRB1 (0.57) | BDKRB1 | |
| SCHEMBL3541065 | 0.83 | BDKRB1 (0.71) | BDKRB1 | |
| SCHEMBL3535716 | 0.83 | BDKRB1 (0.63) | BDKRB1 | |
| SCHEMBL5509661 | 0.82 | BDKRB1 (0.59) | BDKRB1 | |
| SCHEMBL3536416 | 0.82 | BDKRB1 (0.73) | BDKRB1 | |
| SCHEMBL3538848 | 0.82 | BDKRB1 (0.70) | BDKRB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7662811-B2 | N-(((5R)-5-((1-methylethyl)amino)-5,6,7,8-tetrahydro-2-naphthalenyl)methyl)-2-((2R)-1-((4-methylphenyl)sulfonyl)-3-oxo-1,2,3,4-tetrahydro-2-pyrazinyl)acetamide; for treatment of pain and diseases, such as inflammation mediated diseases | AMGEN INC. (US) | 2010-02-16 | — | — | US | claimed |