Glycerin

Glycerin

SCHEMBL9407350

OCC(O)CO.OCCC(O)CO.OCCCC(O)CO

nearest known ligand 0.72

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.72
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
USP2 O75604 1/20 0.34
CYP3A4 P08684 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PTPN1 P18031 1/20 0.33

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
SCHEMBL8952135 0.97 THRB (0.77) THRBLMNAALDH1A1USP2CYP3A4
Glycerin SCHEMBL28966317 0.94 THRB (0.61) THRBLMNAALDH1A1USP2CYP3A4
SCHEMBL3729744 0.91
SCHEMBL721854 0.91
SCHEMBL30340 0.91
SCHEMBL1369000 0.89 THRB (0.72) THRBLMNAALDH1A1USP2CYP3A4
Water SCHEMBL3354792 0.88
Glycerin SCHEMBL1619849 0.88 THRB (0.93) THRBLMNAALDH1A1USP2CYP3A4
SCHEMBL2053941 0.86 THRB (0.68) THRBLMNAALDH1A1USP2CYP3A4
SCHEMBL761878 0.86 THRB (0.77) THRBLMNAALDH1A1USP2CYP3A4

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-5314777-A Phthalic acid ester, fluoroammonium salt RICOH COMPANY, LTD. (JP) 1994-05-24 US disclosed