Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 11/20 | 0.59 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8957422 | 0.84 | GSR (0.71) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL13738690 | 0.74 | GSR (0.59) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL13737852 | 0.74 | GSR (0.59) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL9795224 | 0.74 | GSR (0.59) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL8957312 | 0.74 | GSR (1.00) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL11780937 | 0.74 | GSR (0.59) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL9803285 | 0.73 | GSR (0.71) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL11875600 | 0.72 | GSR (0.60) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL11780669 | 0.72 | GSR (0.60) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL11780182 | 0.72 | GSR (0.60) | GSRCA2ALDH1A1BCHEMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-118063323-A | Beta-halogenated nitrate compound and preparation method and application thereof | 上海师范大学 | 2024-05-24 | — | — | CN | disclosed |