Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28084607

C=CC(=O)OC.CCCCC(CC)C[PH](=O)CC(CC)CCCC

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
HPGD P15428 1/20 0.40
CA2 P00918 5/20 0.39
CA1 P00915 2/20 0.39
CYP3A4 P08684 4/20 0.39
TDP1 Q9NUW8 3/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
RECQL P46063 1/20 0.33
CTSK P43235 1/20 0.33
THRB P10828 1/20 0.33
LMNA P02545 2/20 0.32

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 SCHEMBL28826899 0.83 TSHR (0.62) TSHRHPGDCA2CA1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL27704592 0.83 TSHR (0.62) TSHRHPGDCA2CA1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL27692903 0.82 TSHR (0.69) TSHRHPGDCA2CA1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL3214910 0.81 TSHR (0.88) TSHRHPGDCA2CA1CYP3A4
Acrylic Acid Methyl Ester SCHEMBL15418484 0.79 TSHR (0.57) TSHRHPGDCA2CA1CYP3A4
SCHEMBL8017021 0.79 ALDH1A1 (0.50) TSHRCA2CA1CYP3A4TDP1
Acrylic Acid Methyl Ester SCHEMBL9719491 0.77 TSHR (0.81) TSHRHPGDCA2CA1CYP3A4
Acrylic Acid Ethyl Ester SCHEMBL18424749 0.77 TSHR (0.81) TSHRHPGDCA2CA1CYP3A4
SCHEMBL28056322 0.77 ALDH1A1 (0.48) TSHRCA2CA1CYP3A4TDP1
Acrylic Acid Methyl Ester SCHEMBL27538149 0.77 TSHR (0.50) TSHRHPGDCA2CA1CYP3A4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109073783-A Manufacture the method with the silicone hydrogel contact lenses of reduced evaporation rate 库柏维景国际控股公司 2018-12-21 CN disclosed
CN-108700676-A The silicone hydrogel contact lenses of improved lubricity 库柏维景国际控股公司 2018-10-23 CN disclosed
CN-106573423-B Method of making wettable silicone hydrogel contact lenses 库柏维景国际控股公司 2018-07-03 CN disclosed
CN-106573423-A Method of making wettable silicone hydrogel contact lenses 库柏维景国际控股公司 2017-04-19 CN disclosed
CN-103827175-B Silicone hydrogel contact lenses 库柏维景国际控股公司 2016-08-10 CN disclosed