Di(Hydroxyethyl)Ether

Di(Hydroxyethyl)Ether

SCHEMBL11295445

CC(C)c1ccccc1COCc1ccccc1C(C)C.OCCOCCO

nearest known ligand 0.40

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
GABRB2 P47870 2/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
SLC6A2 P23975 3/20 0.35
TSHR P16473 2/20 0.35
FAAH O00519 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
GABRB1 P18505 1/20 0.35
PTGS1 P23219 1/20 0.35
HTR2C P28335 1/20 0.35
GABRA5 P31644 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
SCHEMBL7771649 0.87 GABRA1 (0.43) GABRA1GABRG2GABRB3LMNAGABRB2
Di(Hydroxyethyl)Ether SCHEMBL22418733 0.85 GABRA1 (0.48) GABRA1GABRG2GABRB3ALDH1A1LMNA
Hydrogen Peroxide SCHEMBL9347056 0.80 GABRA1 (0.36) GABRA1GABRG2GABRB3ALDH1A1LMNA
SCHEMBL13145477 0.79 TSHR (0.56) ALDH1A1LMNAKMT2ATSHRCA1
SCHEMBL8750458 0.78 GABRA1 (0.39) GABRA1GABRG2GABRB3ALDH1A1LMNA
Di(Hydroxyethyl)Ether SCHEMBL11297658 0.77 TSHR (0.39) GABRA1ALDH1A1LMNAGABRB2MEN1
SCHEMBL19304116 0.76 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2TSHR
SCHEMBL1085868 0.76 GABRA1 (0.45) GABRA1GABRG2GABRB3ALDH1A1LMNA
SCHEMBL26726818 0.76 LMNA (0.41) LMNAKMT2ALPAR1
SCHEMBL26723844 0.76 GABRA1 (0.35) GABRA1GABRG2GABRB3ALDH1A1LMNA

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
US-4343732-A HEAT AND WEATHER RESISTANCE, BISPHENOL PHOSPHATE STABILIZER AJINOMOTO COMPANY INCORPORATED (JP) 1982-08-10 US disclosed