Triacetin

Triacetin

SCHEMBL8664971

CC(=O)OCC(COC(C)=O)OC(C)=O.CCCCCCC

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 4/20 0.63
ALDH1A1 P00352 2/20 0.58
LMNA P02545 1/20 0.58
PRKCE Q02156 1/20 0.49
PRKCQ Q04759 1/20 0.49
PRKCD Q05655 1/20 0.49
MAPT P10636 1/20 0.47
LPAR1 Q92633 2/20 0.46
LPAR3 Q9UBY5 2/20 0.46
ENPP2 Q13822 1/20 0.46

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
Cetostearyl Alcohol SCHEMBL27687492 0.93 PRKCA (0.60) PRKCAALDH1A1LMNAPRKCEPRKCQ
Cetyl Alcohol SCHEMBL8600510 0.93 PRKCA (0.60) PRKCAALDH1A1LMNAPRKCEPRKCQ
Triacetin SCHEMBL3680247 0.93 ALDH1A1 (0.57) PRKCAALDH1A1LMNA
SCHEMBL10894210 0.91 ADRA1D (0.55) PRKCAALDH1A1LMNA
SCHEMBL8435468 0.91 ADRA1D (0.55) PRKCAALDH1A1LMNA
Triacetin SCHEMBL17821531 0.91 PRKCA (0.55) PRKCAALDH1A1LMNAMAPT
SCHEMBL10824976 0.91 ADRA1D (0.55) PRKCAALDH1A1LMNA
SCHEMBL8438758 0.91 ADRA1D (0.55) PRKCAALDH1A1LMNA
SCHEMBL11747308 0.91 PRKCA (0.58) PRKCAALDH1A1LMNAPRKCEPRKCQ
SCHEMBL10796873 0.91 PRKCA (0.58) PRKCAALDH1A1LMNAPRKCEPRKCQ

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-5714642-A SELECTIVE ENZYMATIC ACYLATION IN THE PRESENCE OF A CATALYTICALLY EFFECTIVE HYDROLASE IN A BIPHASIC HYDROORGANIC REACTION MEDIUM RHONE-POULENC CHIMIE (FR) 1998-02-03 US disclosed