Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL220688 | 0.76 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL961470 | 0.72 | PTGS2 (0.34) | ALDH1A1 | |
| SCHEMBL17773090 | 0.71 | GSR (0.37) | ALDH1A1 | |
| Nitroglycerin SCHEMBL28548357 | 0.71 | PTGS2 (0.36) | ALDH1A1 | |
| SCHEMBL11649021 | 0.70 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL3865706 | 0.69 | PTGS2 (0.35) | ALDH1A1 | |
| SCHEMBL3872868 | 0.69 | PTGS2 (0.35) | ALDH1A1 | |
| SCHEMBL29242392 | 0.69 | — | — | |
| SCHEMBL3696123 | 0.69 | CA12 (0.36) | ALDH1A1 | |
| SCHEMBL4961745 | 0.68 | ALDH1A1 (0.30) | ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1668008-A4 | NITROSATED AD NITROSYLATED DIURETIC COMPOUDS, COMPOSITIONS AND METHODS OF USE | NITROMED INC (US) | 2009-02-25 | — | — | EP | disclosed |
| EP-1668008-A2 | NITROSATED AD NITROSYLATED DIURETIC COMPOUDS, COMPOSITIONS AND METHODS OF USE | Nitromed, Inc. (US) | 2006-06-14 | — | — | EP | disclosed |
| WO-2005023183-A2 | NITROSATED AD NITROSYLATED DIURETIC COMPOUDS, COMPOSITIONS AND METHODS OF USE | NITROMED, INC. (US) | 2005-03-17 | — | — | WO | disclosed |