Acrylamide

Acrylamide

SCHEMBL28815142

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

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 3/20 0.42
FGFR4 P22455 1/20 0.42
FAAH O00519 3/20 0.32
KMT2A Q03164 2/20 0.32
SOAT1 P35610 2/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
CNR1 P21554 1/20 0.31
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
KDM4E B2RXH2 2/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30

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
SCHEMBL284442 0.78
SCHEMBL284441 0.78
Acrylamide SCHEMBL39859 0.73
Acrylamide SCHEMBL8773893 0.73 TSHR (0.69) TSHRALDH1A1FGFR4FAAHKMT2A
Acrylamide SCHEMBL27989168 0.73 ALDH1A1 (0.52) TSHRALDH1A1FGFR4
Acrylamide SCHEMBL28810031 0.73 ALDH1A1 (0.57) TSHRALDH1A1FGFR4FAAHKMT2A
Acrylamide SCHEMBL27857124 0.72 TSHR (0.58) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Acrylamide SCHEMBL11762696 0.72 ALDH1A1 (0.58) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Acrylamide SCHEMBL2435208 0.71 TSHR (0.50) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2
Acrylamide SCHEMBL193828 0.71 TSHR (0.50) TSHRALDH1A1FGFR4ZDHHC20ZDHHC2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104177532-A Modified vinyl alcohol-series polymer and its preparation method and use LI RUJI 2014-12-03 CN claimed
CN-104177532-A Modified vinyl alcohol-series polymer and its preparation method and use LI RUJI 2014-12-03 CN disclosed