Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.48 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | COMT | P21964 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL6734016 | 0.77 | ALDH1A1 (0.50) | KDM4EALDH1A1GAATDP1HPGD | |
| SCHEMBL27838815 | 0.76 | PIK3CA (0.54) | KDM4EALDH1A1GAAPIK3CAKMT2A | |
| SCHEMBL28227143 | 0.76 | KDM4E (1.00) | KDM4EALDH1A1GAAALPLKMT2A | |
| SCHEMBL30618062 | 0.75 | KDM4E (0.66) | KDM4EALDH1A1GAAALPLCOMT | |
| SCHEMBL3834089 | 0.75 | KDM4E (0.66) | KDM4EALDH1A1GAAALPLCOMT | |
| SCHEMBL28440582 | 0.74 | KDM4E (0.57) | KDM4EALDH1A1GAAPIK3CATDP1 | |
| SCHEMBL27930768 | 0.72 | KDM4E (0.54) | KDM4EALDH1A1GAAPIK3CAALPL | |
| SCHEMBL28654989 | 0.72 | KDM4E (0.57) | KDM4EALDH1A1GAAPIK3CANPSR1 | |
| SCHEMBL9287687 | 0.70 | GAA (0.52) | KDM4EALDH1A1GAARAPGEF4KMT2A | |
| SCHEMBL27838814 | 0.70 | PIK3CA (0.80) | KDM4EALDH1A1PIK3CATDP1KMT2A |
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-108530354-A | A kind of synthetic method of the compound of class containing phenylsulfonylquinoline | 青岛农业大学 | 2018-09-14 | — | — | CN | disclosed |