Ethylene Glycol

Ethylene Glycol

SCHEMBL8328945

C=C.C=C.CCO.OCCO

nearest known ligand 0.60

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Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
TSHR P16473 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 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
Ethylene Glycol SCHEMBL3261295 1.00
Ethylene Glycol SCHEMBL8327293 1.00 ALDH1A1 (0.60) ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10
Ethylene Glycol SCHEMBL8381661 1.00 ALDH1A1 (0.60) ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10
Ethylene Glycol SCHEMBL5685968 0.95 ALDH1A1 (0.55) ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10
Propanol SCHEMBL9313925 0.91 ALDH1A1 (0.50) ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10
Alcohol SCHEMBL8330183 0.89
Alcohol SCHEMBL722166 0.89
Alcohol SCHEMBL11444793 0.89 TSHR (0.75) ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10
Alcohol SCHEMBL1357723 0.89
Alcohol SCHEMBL11319836 0.89 TSHR (0.75) ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10

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-6003987-A Ink set recording apparatus and method using ink set having a dye that becomes insoluble when mixed with another dye CANON KABUSHIKI KAISHA (JP) 1999-12-21 US disclosed