Triethyl Citrate

Triethyl Citrate

SCHEMBL6236671

CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC.N

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
ALDH1A1 P00352 3/20 0.44
TRPA1 O75762 1/20 0.43
PKM P14618 2/20 0.41
KDM4E B2RXH2 1/20 0.41
SOAT1 P35610 1/20 0.41
THRB P10828 1/20 0.40
HTT P42858 1/20 0.39
CYP1A2 P05177 1/20 0.38
HSD11B1 P28845 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP4F2 P78329 2/20 0.36

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
Triethyl Citrate SCHEMBL23465 0.98 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL901127 0.98 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL28041956 0.96 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL14856311 0.96 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL29035980 0.96 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL17898236 0.94 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL28185576 0.94 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL28853817 0.92 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL5250346 0.92 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1
Triethyl Citrate SCHEMBL22498818 0.92 PKM (0.43) GAAMGAMSIMGAM2ALDH1A1

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115315252-A Antiviral composition for preventing or treating infection or respiratory disease after exposure 盈擘医药股份有限公司 2022-11-08 CN disclosed
CN-114040750-A Inhalable bronchodilator sustained-release composition for treating pulmonary diseases 盈擘医药股份有限公司 2022-02-11 CN disclosed
CN-105163720-A Remote loading of sparingly water-soluble drugs into liposomes ZONEONE PHARMA INC 2015-12-16 CN disclosed
WO-2005000954-A1 FLAME-RETARDANT SOOT-CONTAINING POLYURETHANE FOAMS AKZO NOBEL N.V. (NL) 2005-01-06 WO disclosed
EP-1171545-B1 FLAME RETARDANT BLEND CONTAINING MONOMERIC AND OLIGOMERIC FLAME RETARDANTS AKZO NOBEL NV (NL) 2004-02-18 EP disclosed
EP-1218433-B1 POLYURETHANE FOAM CONTAINING FLAME RETARDANT BLEND OF NON-OLIGOMERIC AND OLIGOMERIC FLAME RETARDANTS AKZO NOBEL NV (NL) 2003-08-13 EP disclosed
EP-1218433-A1 POLYURETHANE FOAM CONTAINING FLAME RETARDANT BLEND OF NON-OLIGOMERIC AND OLIGOMERIC FLAME RETARDANTS Akzo Nobel N.V. (NL) 2002-07-03 EP disclosed
EP-1171545-A1 FLAME RETARDANT BLEND CONTAINING MONOMERIC AND OLIGOMERIC FLAME RETARDANTS Akzo Nobel N.V. (NL) 2002-01-16 EP disclosed
WO-2001018088-A1 POLYURETHANE FOAM CONTAINING FLAME RETARDANT BLEND OF NON-OLIGOMERIC AND OLIGOMERIC FLAME RETARDANTS AKZO NOBEL N.V. (NL) 2001-03-15 WO disclosed
WO-2000061700-A1 FLAME RETARDANT BLEND CONTAINING MONOMERIC AND OLIGOMERIC FLAME RETARDANTS AKZO NOBEL N.V. (NL) 2000-10-19 WO disclosed
US-4476930-A A NITROGEN-CONTAINING SALT TO PREVENT DEPOSITION UNION OIL COMPANY OF CALIFORNIA (US) 1984-10-16 US disclosed
US-4394330-A Phosphonate derivatives of polyalkylene polyamines as flame retardants STAUFFER CHEMICAL COMPANY (US) 1983-07-19 US disclosed
US-4163767-A MIXED PHOSPHITE-PHOSPHONATE POLYMER FLAME RETARDANT, INTERMEDIATES FOR THE PREPARATION OF SELF-EXTINGUISHING FLEXIBLE POLYURETHANE FOAMS STAUFFER CHEMICAL COMPANY (US) 1979-08-07 US disclosed
US-4092377-A TRANSESTERIFYING A TERTIARY PHOSPHITE WITH A POLYALKYLENE GLYCOL, REARRANGEMENT BY HEAT STAUFFER CHEMICAL COMPANY (US) 1978-05-30 US disclosed
US-4036789-A FLAME RETARDENT STAUFFER CHEMICAL COMPANY (US) 1977-07-19 US disclosed
US-3996313-A Halogen containing phosphorus monools BORG-WARNER CORPORATION (US) 1976-12-07 US disclosed
US-3989652-A Polyalkylene glycol alkyl or haloalkyl polyphosphonates used as flame retardants in polyurethane foam STAUFFER CHEMICAL COMPANY (US) 1976-11-02 US disclosed
US-3986990-A FLAME RETARDANT POLYURETHANE FOAM CONTAINING POLYALKYLENE GLYCOL ALKYL POLY-PHOSPHITES STAUFFER CHEMICAL COMPANY (US) 1976-10-19 US disclosed
US-3956200-A POLYGLYCOL HYDROGEN POLYPHOSPHONATE STAUFFER CHEMICAL COMPANY (US) 1976-05-11 US disclosed
US-3933696-A Polyalkylene glycol poly-phosphorus compounds in polyurethane foams STAUFFER CHEMICAL COMPANY (US) 1976-01-20 US disclosed