Propylene Glycol

Propylene Glycol

SCHEMBL28071068

CC(O)CO.CC(O)COC(C)CO.CC(O)COC(C)COC(C)CO.CCCC(O)O

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

SLC5A2

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

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.31

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
SCHEMBL4527080 0.94 TDP1 (0.50) TDP1HSD17B10TSHRLMNA
Glycerin SCHEMBL28087126 0.91 TDP1 (0.44) TDP1HSD17B10TSHRLMNA
Butane SCHEMBL2317610 0.87 TDP1 (0.59) TDP1HSD17B10TSHR
Propylene Glycol SCHEMBL17272919 0.87 TDP1 (0.52) TDP1HSD17B10TSHRLMNA
Propylene Glycol SCHEMBL320813 0.87 TDP1 (0.52) TDP1HSD17B10TSHRLMNA
SCHEMBL2270646 0.86 TDP1 (0.50) TDP1HSD17B10TSHRLMNA
Propanol SCHEMBL28164233 0.85 TDP1 (0.57) TDP1HSD17B10TSHR
Alcohol SCHEMBL16163804 0.85 TDP1 (0.55) TDP1HSD17B10TSHR
SCHEMBL3193159 0.84 TDP1 (0.54) TDP1HSD17B10TSHRLMNA
SCHEMBL18322329 0.84 TDP1 (0.54) TDP1HSD17B10TSHRLMNA

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-103109391-B Nanowire-polymer composite electrode 加利福尼亚大学董事会 2016-07-20 CN disclosed