Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL6573893

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

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
TSHR P16473 10/20 0.46
HPGD P15428 1/20 0.44
THRB P10828 2/20 0.43
NPSR1 Q6W5P4 1/20 0.41
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
TP53 P04637 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP3A4 P08684 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
GLO1 Q04760 1/20 0.37
LMNA P02545 1/20 0.37

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 SCHEMBL8736158 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL29246428 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL9342721 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL4889568 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL146757 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL2097752 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL5959889 1.00 ALDH1A1 (0.56) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL9641320 0.98 ALDH1A1 (0.54) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL27220395 0.98 ALDH1A1 (0.54) ALDH1A1TSHRHPGDTHRBNPSR1
Acrylic Acid Ethyl Ester SCHEMBL15486940 0.96 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTHRBNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408914-A1 WATER-RESISTANT AND ABRASION-RESISTANT HAIR COSMETIC AND DECORATIVE COSMETIC Coty B.V. (NL) 2004-04-21 EP disclosed
WO-2003009821-A1 WATER-RESISTANT AND ABRASION-RESISTANT HAIR COSMETIC AND DECORATIVE COSMETIC COTY B.V. (NL) 2003-02-06 WO disclosed