Acrylamide

Acrylamide

SCHEMBL28091591

C=CC(N)=O.CN(C)CCS(N)(=O)=O

nearest known ligand 0.42

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Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
FGFR4 P22455 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.

Compoundsimilaritytop predictedshared targets
Acrylamide SCHEMBL28081090 0.98 ALDH1A1 (0.41) ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL27647203 0.85 ALDH1A1 (0.42) ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL27988527 0.83 ALDH1A1 (0.41) ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL30423400 0.81 ALDH1A1 (0.39) ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL28263729 0.81 ALDH1A1 (0.58) ALDH1A1TSHRFGFR4
SCHEMBL425349 0.81
Ammonia Solution, Strong SCHEMBL27689607 0.79 ALDH1A1 (0.36) ALDH1A1TSHR
Acrylamide SCHEMBL29113250 0.78 ALDH1A1 (0.39) ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL29072239 0.78 ALDH1A1 (0.35) ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL2588866 0.77 ALDH1A1 (0.42) ALDH1A1TSHRFGFR4

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105979929-A Composition in form of an emulsion 莱雅公司 2016-09-28 CN disclosed