Glycerin

Glycerin

SCHEMBL8734337

CC(O)CO.NC(N)=O.OCC(O)CO.OCCO

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

SLC5A2

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

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 3/20 0.45
ALDH1A1 P00352 2/20 0.45
THRB P10828 1/20 0.38
TSHR P16473 2/20 0.32
OR51E2 Q9H255 2/20 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
Propylene Glycol SCHEMBL8730890 0.92 TDP1 (0.59) TDP1LMNAALDH1A1THRBTSHR
Glycerin SCHEMBL9064954 0.89 LMNA (0.56) TDP1LMNAALDH1A1THRBTSHR
Glycerin SCHEMBL11848316 0.88 TDP1 (0.48) TDP1LMNAALDH1A1THRBTSHR
Glycerin SCHEMBL8462303 0.87 TDP1 (0.67) TDP1LMNAALDH1A1THRBTSHR
Propylene Glycol SCHEMBL8832136 0.87
Glycerin SCHEMBL8328163 0.84 LMNA (0.64) TDP1LMNAALDH1A1THRBOR51E2
Glycerin SCHEMBL4538901 0.84 LMNA (0.64) TDP1LMNAALDH1A1THRBOR51E2
Glycerin SCHEMBL8537586 0.81 LMNA (0.53) TDP1LMNAALDH1A1THRBTSHR
Glycerin SCHEMBL27534587 0.81 LMNA (0.60) TDP1LMNAALDH1A1THRBOR51E2
Glycerin SCHEMBL11032789 0.81 LMNA (0.60) TDP1LMNAALDH1A1THRBOR51E2

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
WO-1998019545-A1 COMPOSITION AND METHOD FOR THE TREATMENT OF VAGINAL YEAST INFECTIONS REINHARD MARK S (US) 1998-05-14 WO disclosed