Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Acrylamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.69 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CA5A | P35218 | 2/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | NT5E | P21589 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Acrylamide SCHEMBL27659043 | 0.97 | ALDH1A1 (0.73) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL692432 | 0.97 | ALDH1A1 (0.73) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28217381 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28248949 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28253722 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28327605 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28835519 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28881120 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL28788499 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E | |
| Acrylamide SCHEMBL14118867 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRFGFR4BLMKDM4E |
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-6290970-B1 | Transferrin receptor protein of Moraxella | AVENTIS PASTEUR LIMITED (CA) | 2001-09-18 | — | — | US | claimed |