Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28099897

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

nearest known ligand 0.39

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.39
HPGD P15428 1/20 0.38
ALDH1A1 P00352 5/20 0.37
TP53 P04637 3/20 0.37
HIF1A Q16665 3/20 0.37
CYP3A4 P08684 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
THRB P10828 1/20 0.33
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL21995155 0.96 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
Acrylic Acid Methyl Ester SCHEMBL29124112 0.81 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL23813370 0.79 ALDH1A1 (0.33) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28007306 0.79 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8425135 0.78 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
Acrylic Acid Methyl Ester SCHEMBL2359202 0.77 MAPT (0.48) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28116127 0.77 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27465283 0.77 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL29178049 0.77 ALDH1A1 (0.52) TSHRALDH1A1THRBCYP2D6CYP2C19
SCHEMBL2024200 0.75 TSHR (0.48) TSHRHPGDALDH1A1TP53HIF1A

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-106030352-A Method for manufacturing polarizing multilayer film and method for manufacturing polarizing plate 住友化学株式会社 2016-10-12 CN disclosed