Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28058559

C=CC(=O)OC.CC(C)(CO)C(=O)O.CC(C)(CO)CO

nearest known ligand 0.38

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
TSHR P16473 3/20 0.33
HCAR2 Q8TDS4 2/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HPGD P15428 1/20 0.31
ACLY P53396 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
Acrylic Acid Methyl Ester SCHEMBL27551471 0.95 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Pivalate SCHEMBL27599809 0.89 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Acrylic Acid Methyl Ester SCHEMBL27544299 0.89 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Acrylic Acid SCHEMBL29363792 0.83 LMNA (0.42) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Acrylic Acid SCHEMBL7736878 0.83 LMNA (0.42) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL106116 0.81 ALDH1A1 (0.53) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Adipic Acid SCHEMBL28083755 0.81 TSHR (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Acrylic Acid Methyl Ester SCHEMBL27828132 0.81 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Vinyl Ether SCHEMBL16292868 0.80 ACLY (0.32) ACLY
Acrylic Acid Methyl Ester SCHEMBL27476244 0.80 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4MAPK1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105829101-A RESIN LAMINATE AND PRODUCTION METHOD THEREFOR 三菱丽阳株式会社 2016-08-03 CN disclosed
CN-105820359-A Glass plate substitute film and display device 惠和株式会社 2016-08-03 CN disclosed
CN-105794331-A Electronic element and sheet material 东洋油墨SC控股株式会社 2016-07-20 CN disclosed