Glycerin

Glycerin

SCHEMBL9060924

C[N+](C)(C)CCOS(=O)(=O)O.OCC(O)CO

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.45
CHRM5 P08912 6/20 0.35
CHRM1 P11229 6/20 0.35
CHRM3 P20309 6/20 0.35
CHRM2 P08172 5/20 0.35
CHRM4 P08173 5/20 0.35
CHRNB2 P17787 4/20 0.35
CHRNA4 P43681 4/20 0.35
CHRNA7 P36544 3/20 0.35
HTR1A P08908 2/20 0.35
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
PGR P06401 1/20 0.35
TBXA2R P21731 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA10 Q9GZZ6 1/20 0.35
CHRNA9 Q9UGM1 1/20 0.35
GALR3 O60755 2/20 0.35
LMNA P02545 3/20 0.34

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
SCHEMBL339065 0.86 CHRM5 (0.44) SMN1; SMN2CHRM5CHRM1CHRM3CHRM2
SCHEMBL28176595 0.84 CHRM5 (0.43) SMN1; SMN2CHRM5CHRM1CHRM3CHRM2
SCHEMBL9060915 0.79 SMN1; SMN2 (0.54) SMN1; SMN2CHRM5CHRM1CHRM3CHRM2
Glycerin SCHEMBL3242950 0.79 CA1 (0.41) LMNAALDH1A1
Levocarnitine SCHEMBL29564168 0.78 MAPT (0.58) SMN1; SMN2CHRM5CHRM1CHRM3CHRM2
Choline SCHEMBL27827603 0.76 LMNA (0.50) SMN1; SMN2LMNAMAPTALDH1A1BBOX1
Glycerin SCHEMBL3250214 0.74 LMNA (0.41) LMNAALDH1A1
SCHEMBL31594744 0.73 FNTA (0.33) SMN1; SMN2CHRM5CHRM1CHRM3CHRM2
Glycerin SCHEMBL4930912 0.73 USP2 (0.53) LMNABLMTSHRMAPK1
Glycerin SCHEMBL27580187 0.73 USP2 (0.53) LMNABLMTSHRMAPK1

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
EP-0727491-A1 Enzymatic synthesis of soluble phosphatides from phospholipids THE LIPOSOME COMPANY, INC. (US) 1996-08-21 EP claimed