Ethylene Glycol

Ethylene Glycol

SCHEMBL28291570

CC(O)COCC(C)O.CCC(O)OC(O)CC.OCCO.OCCO

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 2/20 0.35
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.30

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
Ethylene Glycol SCHEMBL28088964 1.00 TSHR (0.56) TSHRHSD17B10TDP1MAPK1KDM4E
SCHEMBL22720974 0.93 TSHR (0.65) TSHRHSD17B10TDP1MAPK1KDM4E
Hydroxyl Radical SCHEMBL28246375 0.91 TSHR (0.62) TSHRHSD17B10TDP1MAPK1KDM4E
Di(Hydroxyethyl)Ether SCHEMBL28225683 0.90 TSHR (0.50) TSHRHSD17B10TDP1MAPK1
Ethylene SCHEMBL28071186 0.89 TSHR (0.59) TSHRHSD17B10TDP1MAPK1KDM4E
Triethylene Glycol SCHEMBL28289836 0.88 TSHR (0.48) TSHRHSD17B10TDP1MAPK1
Glycerin SCHEMBL28325862 0.88 TSHR (0.52) TSHRHSD17B10TDP1MAPK1KDM4E
SCHEMBL28327378 0.87 TSHR (0.56) TSHRHSD17B10TDP1MAPK1KDM4E
Cyclohexane SCHEMBL28247724 0.87 TSHR (0.56) TSHRHSD17B10TDP1MAPK1KDM4E
Ethylene Glycol SCHEMBL904502 0.83 TSHR (0.81) TSHRTDP1

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-109640932-A Composition comprising aqueous bead 莱雅公司 2019-04-16 CN disclosed