Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28069339

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

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
TSHR P16473 7/20 0.37
HPGD P15428 1/20 0.35
ALDH1A1 P00352 6/20 0.35
TP53 P04637 3/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TGM2 P21980 1/20 0.31
LMNA P02545 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
SCHEMBL347369 0.92
SCHEMBL3806600 0.90
SCHEMBL29262874 0.90
Ethylene SCHEMBL16566745 0.90 TSHR (0.39) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid Methyl Ester SCHEMBL29198034 0.87
Acrylic Acid Methyl Ester SCHEMBL1854813 0.87 HCAR2 (0.56) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid Methyl Ester SCHEMBL9108 0.87
Acrylic Acid Methyl Ester SCHEMBL7645157 0.87 HCAR2 (0.56) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid SCHEMBL28094954 0.85 LMNA (0.50) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid Methyl Ester SCHEMBL2957775 0.84

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-105774284-A Image recording method, ink and liquid composition 佳能株式会社 2016-07-20 CN disclosed