Acrylic Acid

Acrylic Acid

SCHEMBL28813622

C=CC(=O)O.OCCc1sccc1-c1ccccc1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.44
PTPN1 P18031 1/20 0.38
GSTO1 P78417 4/20 0.36
FABP4 P15090 1/20 0.35
FABP5 Q01469 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 2/20 0.34
RXFP1 Q9HBX9 2/20 0.34
PTGS2 P35354 1/20 0.33
AKT1 P31749 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
LTB4R Q15722 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL9439516 0.74 BCAT2 (0.51) BCAT2PTPN1CYP1A2KMT2ARXFP1
SCHEMBL9808839 0.74 BCAT2 (0.40) BCAT2PTPN1FABP4FABP5CYP1A2
SCHEMBL27344560 0.73 ALDH1A1 (0.44) BCAT2PTPN1HPGDKMT2AALDH1A1
SCHEMBL5107107 0.73 BCAT2 (0.48) BCAT2PTPN1FABP4FABP5HPGD
SCHEMBL27816699 0.72 BCAT2 (0.41) BCAT2PTPN1RXFP1PTGS2
Acrylic Acid SCHEMBL28332055 0.71 CYP2C19 (0.47) CYP2C9HPGDCYP2C19ALDH1A1
Phenylethyl Alcohol SCHEMBL27839012 0.71 TDP1 (0.67) CYP3A4CYP2C9CYP2C19KMT2ARXFP1
SCHEMBL5147356 0.70 BCAT2 (0.43) BCAT2PTPN1FABP4FABP5HPGD
Biphenyl SCHEMBL1311763 0.70 LMNA (0.56) CYP3A4CYP2C9HPGDKMT2AAKT1
Biphenyl SCHEMBL36309 0.70 LMNA (0.56) CYP3A4CYP2C9HPGDKMT2AAKT1

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-114867925-A Multi-surface passive cooling article 3M创新有限公司 2022-08-05 CN disclosed