Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | TK1 | P04183 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4566407 | 0.80 | SNCA (0.48) | ALDH1A1HTTNAMPTSNCA | |
| SCHEMBL28100323 | 0.78 | ALDH1A1 (0.41) | ALDH1A1HTTNAMPTNOS2 | |
| SCHEMBL16481109 | 0.74 | ALDH1A1 (0.37) | ALDH1A1HTTNAMPTNOS2 | |
| SCHEMBL369224 | 0.74 | NAMPT (0.51) | ALDH1A1HTTNAMPT | |
| SCHEMBL29749636 | 0.73 | L3MBTL1 (0.37) | ALDH1A1HTTNAMPTNOS2 | |
| Methyl Alcohol SCHEMBL29259257 | 0.73 | NAMPT (0.50) | ALDH1A1HTTNAMPT | |
| SCHEMBL9211267 | 0.71 | ALDH1A1 (0.36) | ALDH1A1HTTNAMPTNOS2 | |
| SCHEMBL19100018 | 0.71 | LMNA (0.53) | ALDH1A1NAMPT | |
| SCHEMBL930017 | 0.70 | ALDH1A1 (0.42) | ALDH1A1HTTNOS2 | |
| SCHEMBL29058357 | 0.70 | ALDH1A1 (0.47) | ALDH1A1NAMPTNOS2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105461629-B | A kind of preparation method of the formic acid esters of 3 fluoroalkyl 1H pyrazoles 4 | 天津大学 | 2018-02-16 | — | — | CN | claimed |
| CN-105461629-B | A kind of preparation method of the formic acid esters of 3 fluoroalkyl 1H pyrazoles 4 | 天津大学 | 2018-02-16 | — | — | CN | disclosed |
| CN-105461629-A | Preparation method of 3-fluoroalkyl-1H-pyrazole-4-formic ester | UNIV TIANJIN | 2016-04-06 | — | — | CN | disclosed |