Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 11/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28921005 | 0.83 | — | — | |
| SCHEMBL16242235 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242339 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242236 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242363 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242302 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242356 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242257 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242286 | 0.81 | GSR (0.47) | GSRCA2ALDH1A1MAPTBCHE | |
| SCHEMBL16242258 | 0.81 | GSR (0.47) | 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 |
|---|---|---|---|---|---|---|---|
| US-4448587-A | ALKYL NITRATES AND ALKOXYALKYL NITRATES AS ADDITIVES | ETHYL CORPORATION (US) | 1984-05-15 | — | — | US | disclosed |