Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL28134536

C=C(C)C(=O)OCC.C=C(C)C(=O)OCc1ccccc1.C=CC(=O)OCC.C=CC(=O)OCCC.C=CC(=O)OCc1ccccc1.CC(C)C

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.40
▸ CTSL P07711 3/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TSHR P16473 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MBOAT4 Q96T53 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.35
▸ CTSB P07858 2/20 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 Ethyl Ester SCHEMBL28305770 0.94 THRB (0.40) THRBCTSLALDH1A1HCAR2NR1H4
Acrylic Acid Ethyl Ester SCHEMBL28277476 0.89 ALDH1A1 (0.44) THRBCTSLALDH1A1HCAR2NR1H4
SCHEMBL28246245 0.89 ALDH1A1 (0.49) THRBALDH1A1HCAR2NR1H4LMNA
Acrylic Acid Ethyl Ester SCHEMBL3690840 0.89 ALDH1A1 (0.49) THRBCTSLALDH1A1HCAR2NR1H4
SCHEMBL4170802 0.85 ALDH1A1 (0.53) THRBALDH1A1HCAR2LMNAL3MBTL1
SCHEMBL7852013 0.84 TSHR (0.55) THRBALDH1A1HCAR2L3MBTL1TSHR
Acrylic Acid Ethyl Ester SCHEMBL10600284 0.82 ALDH1A1 (0.42) THRBCTSLALDH1A1HCAR2NR1H4
Propene SCHEMBL28187730 0.82 TSHR (0.52) THRBALDH1A1HCAR2L3MBTL1TSHR
Acrylic Acid Ethyl Ester SCHEMBL9492913 0.81 HCAR2 (0.56) THRBALDH1A1HCAR2NR1H4LMNA
Acrylic Acid Ethyl Ester SCHEMBL8943201 0.80 ALDH1A1 (0.39) THRBCTSLALDH1A1HCAR2NR1H4

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-105163947-B Cloth print medium 惠普发展公司,有限责任合伙企业 2017-04-05 — — CN disclosed
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