Acrylic Acid

Acrylic Acid

SCHEMBL27540586

C=CC(=O)O.CC(C)(OOC(C)(C)c1ccccc1)c1ccccc1.O=C(O)O

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Acrylic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.63
ALDH1A1 P00352 6/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 2/20 0.44
HTT P42858 1/20 0.42
KMT2A Q03164 3/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 2/20 0.40
KCNN4 O15554 1/20 0.40
HIF1A Q16665 1/20 0.40
AKT1 P31749 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39

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
Bicarbonate SCHEMBL28584905 0.88 MAPK1 (0.81) MAPK1ALDH1A1ALOX15TSHRKMT2A
Bicarbonate SCHEMBL28837071 0.88 MAPK1 (0.81) MAPK1ALDH1A1ALOX15TSHRKMT2A
Acrylamide SCHEMBL28336053 0.87 MAPK1 (0.61) MAPK1ALDH1A1ALOX15TSHRHTT
SCHEMBL8883023 0.82 MAPK1 (0.53) MAPK1ALDH1A1ALOX15TSHRHTT
Acetone SCHEMBL27544937 0.82 MAPK1 (0.77) MAPK1ALDH1A1ALOX15TSHRKMT2A
Acetic Acid SCHEMBL28355097 0.82 MAPK1 (0.77) MAPK1ALDH1A1ALOX15TSHRKMT2A
Hydrogen Peroxide SCHEMBL22163808 0.82 MAPK1 (0.94) MAPK1ALDH1A1ALOX15TSHRKMT2A
SCHEMBL27810773 0.81 MAPK1 (0.63) MAPK1ALDH1A1ALOX15TSHRHTT
Methacrylic Acid SCHEMBL27561274 0.81 MAPK1 (0.63) MAPK1ALDH1A1ALOX15TSHRHTT
Methyl Alcohol SCHEMBL28217041 0.80 MAPK1 (0.90) MAPK1ALDH1A1ALOX15TSHRKMT2A

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
CN-1309778-C Preparation for ternary ethylene-propylene rubber reinforced by nano calcium carbonate UNIV SHANGHAI JIAOTONG (CN) 2007-04-11 CN disclosed
CN-1709960-A Preparation for ternary ethylene-propylene rubber reinforced by nano calcium carbonate UNIV SHANGHAI JIAOTONG (CN) 2005-12-21 CN disclosed