Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL372212 | 1.00 | THRB (0.44) | THRBLMNA | |
| SCHEMBL12966695 | 1.00 | THRB (0.44) | THRBLMNA | |
| SCHEMBL10048336 | 0.74 | THRB (0.44) | THRBLMNA | |
| SCHEMBL15218988 | 0.74 | THRB (0.44) | THRBLMNA | |
| SCHEMBL1735065 | 0.74 | THRB (0.44) | THRBLMNA | |
| SCHEMBL196060 | 0.74 | THRB (0.44) | THRBLMNA | |
| SCHEMBL12753013 | 0.74 | — | — | |
| SCHEMBL10016808 | 0.74 | THRB (0.44) | THRBLMNA | |
| SCHEMBL10552467 | 0.71 | THRB (0.41) | THRBLMNA | |
| Isosorbide SCHEMBL699485 | 0.71 | THRB (0.52) | THRBLMNA |
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-2005018561-A2 | NITROSATED AND NITROSYLATED CARDIOVASCULAR COMPOUNDS, COMPOSITIONS AND METHODS OF USE | NITROMED, INC. (US) | 2005-03-03 | — | — | WO | disclosed |