Acrylamide

Acrylamide

SCHEMBL28466599

C=CC(N)=O.C=CN1CCCCCC1=O

nearest known ligand 0.38

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
FGFR4 P22455 1/20 0.38
LMNA P02545 2/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
MITF O75030 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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 SCHEMBL1162173 0.93 TSHR (0.42) TSHRALDH1A1FGFR4LMNAKMT2A
Acrylamide SCHEMBL18066844 0.93 TSHR (0.42) TSHRALDH1A1FGFR4LMNAKMT2A
Acrylamide SCHEMBL6025647 0.88 TSHR (0.39) TSHRALDH1A1FGFR4LMNACA12
Acrylic Acid SCHEMBL5183727 0.88 KMT2A (0.37) TSHRALDH1A1LMNAKMT2AMITF
Acrylic Acid SCHEMBL20866354 0.88 KMT2A (0.37) TSHRALDH1A1LMNAKMT2AMITF
SCHEMBL23160942 0.87 ALDH1A1 (0.35) ALDH1A1KMT2AMITFSMN1; SMN2
SCHEMBL8370667 0.87 ALDH1A1 (0.35) ALDH1A1KMT2AMITFSMN1; SMN2
SCHEMBL26239 0.87 ALDH1A1 (0.35) ALDH1A1KMT2AMITFSMN1; SMN2
SCHEMBL44424 0.87 ALDH1A1 (0.35) ALDH1A1KMT2AMITFSMN1; SMN2
SCHEMBL29650529 0.87 ALDH1A1 (0.35) ALDH1A1KMT2AMITFSMN1; SMN2

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-110467701-B Natural gas hydrate inhibitor, compound inhibitor and preparation method thereof 西北大学 2020-10-27 CN disclosed
CN-111656087-A Film for LED backlight and LED backlight 日东电工株式会社 2020-09-11 CN disclosed