Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC5 | P28715 | 1/20 | 0.62 |
| ▸ | FEN1 | P39748 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | GSK3B | P49841 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.59 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.59 |
| ▸ | PARP1 | P09874 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL97933 | 1.00 | ERCC5 (0.62) | ERCC5FEN1ALDH1A1GSK3BMAPK1 | |
| SCHEMBL29621003 | 1.00 | ERCC5 (0.62) | ERCC5FEN1ALDH1A1GSK3BMAPK1 | |
| Hydrogen Peroxide SCHEMBL28819321 | 0.98 | ERCC5 (0.66) | ERCC5FEN1ALDH1A1GSK3BMAPK1 | |
| SCHEMBL29962144 | 0.85 | ERCC5 (0.76) | ERCC5FEN1MAPK1PARP1MAPT | |
| SCHEMBL11791699 | 0.85 | ERCC5 (0.76) | ERCC5FEN1MAPK1PARP1MAPT | |
| SCHEMBL2598234 | 0.84 | ERCC5 (0.59) | ERCC5FEN1ALDH1A1PARP1GAA | |
| SCHEMBL1266993 | 0.83 | ERCC5 (0.62) | ERCC5FEN1ALDH1A1PARP1GAA | |
| SCHEMBL1712221 | 0.83 | ERCC5 (0.62) | ERCC5FEN1ALDH1A1PARP1GAA | |
| SCHEMBL14101616 | 0.82 | ERCC5 (0.61) | ERCC5FEN1ALDH1A1PARP1GAA | |
| SCHEMBL8286976 | 0.82 | ERCC5 (0.61) | ERCC5FEN1ALDH1A1PARP1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-7632665-B2 | biocatalysis in presence of alcohol dehydrogenase, for reducing acetophenone, 2-chloroacetophenone, 4-chloroacetophenone or 2,3'-dichloro-acetophenone to alcohols | EVONIK DEGUSSA GMBH (DE) | 2009-12-15 | — | — | US | disclosed |