Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL28169251 | 0.87 | ALDH1A1 (0.68) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL2201840 | 0.87 | ALDH1A1 (0.74) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL1287895 | 0.87 | ALDH1A1 (0.74) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL5272119 | 0.87 | ALDH1A1 (0.74) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL28013256 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL28013831 | 0.85 | MAPT (0.64) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL29290740 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL28169361 | 0.85 | ALDH1A1 (0.65) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL27782946 | 0.85 | ALDH1A1 (0.71) | ALDH1A1HTTALOX15PLK1NPC1 | |
| Quinoline SCHEMBL27627058 | 0.83 | ALDH1A1 (0.53) | ALDH1A1HTTALOX15PLK1NPC1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105175392-B | A kind of carboxylic acid compound containing thiophene-structure and amide compound containing thiophene-structure and preparation method thereof | 湖南大学 | 2019-04-19 | — | — | CN | claimed |
| CN-106866646-A | It is a kind of to be used to synthesize the new catalytic direct dehydrogenation coupling method containing thiophene-structure alkane compound | 湖南大学 | 2017-06-20 | — | — | CN | claimed |
| CN-105175392-B | A kind of carboxylic acid compound containing thiophene-structure and amide compound containing thiophene-structure and preparation method thereof | 湖南大学 | 2019-04-19 | — | — | CN | disclosed |
| CN-106866646-A | It is a kind of to be used to synthesize the new catalytic direct dehydrogenation coupling method containing thiophene-structure alkane compound | 湖南大学 | 2017-06-20 | — | — | CN | disclosed |
| CN-105175392-A | Carboxylic acid compounds containing thiophene structures and amide compounds containing thiophene structures and preparation method for carboxylic acid compounds and amide compounds | UNIV HUNAN | 2015-12-23 | — | — | CN | disclosed |
| CN-104496870-A | Catalytic synthesis method of sulfur-containing carboxylic acid compound and sulfur-containing amide compound | UNIV HUNAN | 2015-04-08 | — | — | CN | disclosed |