Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 11/20 | 0.54 |
| ▸ | CA2 | P00918 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3492266 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL10157707 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL636136 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL1919263 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL636135 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL2412882 | 0.91 | GSR (0.46) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL2441930 | 0.91 | GSR (0.46) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL637809 | 0.91 | GSR (0.46) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL2410006 | 0.91 | GSR (0.46) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL10158385 | 0.91 | GSR (0.46) | GSRCA2ALDH1A1MAPTBCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-2326652-A1 | NITRO DERIVATIVES OF FURASEMIDE AND THEIR USE AS DIURETICS | Merck Sharp & Dohme Corp. (US) | 2011-06-01 | — | — | EP | disclosed |