Acrylamide

Acrylamide

SCHEMBL28009283

C=C(C)C(=O)OCCN.C=CC(N)=O

nearest known ligand 0.47

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.47
TSHR P16473 9/20 0.46
ALDH1A1 P00352 8/20 0.41
FGFR4 P22455 1/20 0.41
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
HPGD P15428 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MAPT P10636 1/20 0.30
CNR1 P21554 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
Acrylamide SCHEMBL27895820 0.98 THRB (0.46) THRBTSHRALDH1A1FGFR4TDP1
Acrylamide SCHEMBL9232934 0.98 THRB (0.46) THRBTSHRALDH1A1FGFR4TDP1
Acrylic Acid SCHEMBL22733735 0.89 THRB (0.47) THRBTSHRALDH1A1TDP1POLB
Propene SCHEMBL8633418 0.89 THRB (0.50) THRBTSHRALDH1A1TDP1POLB
SCHEMBL69712 0.88
Acrylic Acid SCHEMBL28405215 0.87 THRB (0.46) THRBTSHRALDH1A1TDP1POLB
SCHEMBL22576033 0.86 THRB (0.52) THRBTSHRALDH1A1TDP1POLB
Hydrochloric Acid SCHEMBL148456 0.86 THRB (0.55) THRBTSHRALDH1A1TDP1POLB
Ammonia Solution, Strong SCHEMBL22612067 0.86 THRB (0.55) THRBTSHRALDH1A1TDP1POLB
Bromide SCHEMBL4441948 0.86 THRB (0.55) THRBTSHRALDH1A1TDP1POLB

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-102844662-B Ligand-guanidino functional polymers 3M INNOVATIVE PROPERTIES CO 2015-04-29 CN disclosed