Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 12/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.59 |
| ▸ | GAA | P10253 | 10/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 10/20 | 0.54 |
| ▸ | TP53 | P04637 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | NPY1R | P25929 | 1/20 | 0.54 |
| ▸ | NPY2R | P49146 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 8/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | CASP1 | P29466 | 5/20 | 0.52 |
| ▸ | CASP7 | P55210 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.52 |
| ▸ | RECQL | P46063 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28369694 | 0.80 | GAA (0.60) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL1966999 | 0.74 | GAA (1.00) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL20889799 | 0.73 | GAA (0.67) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL20889290 | 0.72 | GAA (0.65) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL20889798 | 0.72 | NR1H4 (0.71) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL28619420 | 0.72 | GAA (0.51) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL6645121 | 0.71 | GAA (0.71) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL1966995 | 0.70 | ADORA1 (0.63) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL28373238 | 0.70 | NR1H4 (0.55) | HPGDALDH1A1GAAKDM4EHTT | |
| SCHEMBL20889719 | 0.69 | TRIM33 (0.66) | HPGDALDH1A1GAAKDM4EHTT |
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-109824702-B | Bis (2-heteroaryl imidazo [1,2-a ] pyridine-3-yl) thioether compound and synthetic method thereof | 郑州大学 | 2020-03-31 | — | — | CN | disclosed |