Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL28293402

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

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.67
CYP3A4 P08684 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 1/20 0.45
ALDH1A1 P00352 6/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 3/20 0.41
CA2 P00918 1/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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 SCHEMBL2015862 0.92 TSHR (0.64) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL4943355 0.91 TSHR (0.76) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL6568874 0.91 TSHR (0.76) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL9065069 0.91 TSHR (0.81) TSHRCYP3A4TDP1ATMALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL27975992 0.89 TSHR (0.61) TSHRCYP3A4TDP1ATMALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL690098 0.88 TSHR (0.71) TSHRCYP3A4TDP1ATMALDH1A1
Acrylic Acid SCHEMBL2462157 0.88 TSHR (0.71) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL1448030 0.88 TSHR (0.70) TSHRCYP3A4TDP1ATMALDH1A1
Methacrylic Acid SCHEMBL28858997 0.87 TSHR (0.78) TSHRCYP3A4TDP1ATMALDH1A1
Acrylic Acid SCHEMBL8083638 0.87 TSHR (0.66) TSHRCYP3A4TDP1ATMALDH1A1

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-109790366-A The manufacturing method of (methyl) acrylic copolymer, resin combination, its formed body and formed body 三菱瓦斯化学株式会社 2019-05-21 CN disclosed