Di(Hydroxyethyl)Ether

Di(Hydroxyethyl)Ether

SCHEMBL28099324

CCC(CO)(CO)CO.OCC(O)CO.OCCO.OCCOCCO

nearest known ligand 0.39

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Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
THRB P10828 2/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
PLA2G2C Q5R387 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
Di(Hydroxyethyl)Ether SCHEMBL28412895 0.88 TSHR (0.50) TSHRMAPK1ALDH1A1MEN1KMT2A
Di(Hydroxyethyl)Ether SCHEMBL2943020 0.85 TSHR (0.53) TSHRMAPK1ALDH1A1MEN1KMT2A
Triethylene Glycol SCHEMBL537748 0.83 MEN1 (0.55) TSHRMAPK1ALDH1A1MEN1KMT2A
Glycerin SCHEMBL330202 0.83 LMNA (0.50) TSHRALDH1A1THRBUSP2LMNA
Glycerin SCHEMBL995830 0.83 LMNA (0.50) TSHRALDH1A1THRBUSP2LMNA
Glycerin SCHEMBL28236601 0.82 ALDH1A1 (0.39) ALDH1A1THRBLMNA
Glycerin SCHEMBL7954956 0.81 LMNA (0.47) TSHRALDH1A1THRBUSP2LMNA
Glycerin SCHEMBL28068047 0.81 LMNA (0.47) TSHRALDH1A1THRBUSP2LMNA
Di(Hydroxyethyl)Ether SCHEMBL28201339 0.81 TSHR (0.53) TSHRMAPK1ALDH1A1MEN1KMT2A
Di(Hydroxyethyl)Ether SCHEMBL6658442 0.81 TSHR (0.59) TSHRMAPK1ALDH1A1MEN1KMT2A

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-105980126-A Insulation assembly for storage container and method of making same 巴斯夫欧洲公司 2016-09-28 CN disclosed