Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL27486271

C=C(C)C(=O)O.C=C(C)C(=O)O.C=C(C)C(=O)O.C=CC(=O)OCC.CCC(CO)(CO)CO

nearest known ligand 0.50

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TP53 P04637 3/20 0.50
HIF1A Q16665 3/20 0.50
CYP3A4 P08684 2/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
THRB P10828 3/20 0.46
TSHR P16473 7/20 0.39
HPGD P15428 1/20 0.39
HCAR2 Q8TDS4 1/20 0.37
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
HSD17B10 Q99714 2/20 0.34
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 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
Acrylic Acid Ethyl Ester SCHEMBL7163801 0.90 ALDH1A1 (0.60) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL11105086 0.90 ALDH1A1 (0.60) ALDH1A1TP53HIF1ACYP3A4MAPK1
Methacrylic Acid SCHEMBL15789442 0.89 ALDH1A1 (0.62) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL156717 0.87 TSHR (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL9818307 0.87 TSHR (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL9069456 0.87 TSHR (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
Methacrylic Acid SCHEMBL28068798 0.86 ALDH1A1 (0.43) ALDH1A1TP53HIF1ACYP3A4MAPK1
Methacrylic Acid SCHEMBL28085910 0.85 TSHR (0.61) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL5860506 0.85 TSHR (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL10809888 0.85 TSHR (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1

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-1200647-A Product and method for placing particles on contact pads of electronic devices DU PONT (US) 1998-12-02 CN disclosed