Acrylic Acid

Acrylic Acid

SCHEMBL28345252

C=CC(=O)O.CCCCNC

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
EPHX1 P07099 5/20 0.46
LMNA P02545 1/20 0.43
ALOX15 P16050 2/20 0.43
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.39
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH7 P40394 1/20 0.38
ACHE P22303 1/20 0.36
MMP2 P08253 1/20 0.36
FAAH O00519 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 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 SCHEMBL27572702 0.86 LMNA (0.48) ZDHHC20ZDHHC2EPHX1LMNAALOX15
Oxalic Acid SCHEMBL28276534 0.81 ALOX15 (0.62) EPHX1ALOX15ACHEMMP2ALDH1A1
Acetic Acid SCHEMBL9498328 0.81 EPHX1 (0.55) EPHX1ALOX15ACHEMMP2ALDH1A1
Hexane SCHEMBL1603152 0.81 LMNA (0.59) ZDHHC20ZDHHC2LMNAALOX15TSHR
Acrylic Acid SCHEMBL29743129 0.81 LMNA (0.59) ZDHHC20ZDHHC2LMNAALOX15TSHR
Hexane SCHEMBL29985034 0.81 LMNA (0.59) ZDHHC20ZDHHC2LMNAALOX15TSHR
Acrylic Acid SCHEMBL1399476 0.81 LMNA (0.42) ZDHHC20ZDHHC2LMNAALOX15TSHR
Carbamic Acid SCHEMBL28983310 0.79 ALOX15 (0.54) EPHX1ALOX15ACHEMMP2ALDH1A1
Acrylic Acid SCHEMBL11250536 0.79 ZDHHC20 (0.75) ZDHHC20ZDHHC2EPHX1ALOX15TSHR
Acrylic Acid Ethyl Ester SCHEMBL5274881 0.79 TSHR (0.56) ZDHHC20ZDHHC2EPHX1TSHRHPGD

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-110680756-A Enamel repairing material 慧生医学科技(徐州)有限公司 2020-01-14 CN disclosed