Glutathione Ethyl Ester

Glutathione Ethyl Ester

SCHEMBL7527153

CCOC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)C(=O)O.O=S(=O)(O)O

nearest known ligand 0.65

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Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO

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

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.65
GSTK1 Q9Y2Q3 1/20 0.65
GLO1 Q04760 2/20 0.50
NOD1 Q9Y239 9/20 0.44
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
PGGT1B P53609 1/20 0.39
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38

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
Glutathione Ethyl Ester SCHEMBL7527777 1.00 PTGS1 (0.65) PTGS1GSTK1GLO1NOD1FNTA
Glutathione Ethyl Ester SCHEMBL7526098 0.98 PTGS1 (0.65) PTGS1GSTK1GLO1NOD1FNTA
Glutathione Ethyl Ester SCHEMBL7530375 0.98 PTGS1 (0.65) PTGS1GSTK1GLO1NOD1FNTA
Glutathione Ethyl Ester SCHEMBL7530345 0.96 PTGS1 (0.71) PTGS1GSTK1GLO1NOD1KMT2A
Glutathione Ethyl Ester SCHEMBL9817298 0.96 PTGS1 (0.71) PTGS1GSTK1GLO1NOD1KMT2A
Glutathione Ethyl Ester SCHEMBL680361 0.96 PTGS1 (0.71) PTGS1GSTK1GLO1NOD1KMT2A
Glutathione Ethyl Ester SCHEMBL8749892 0.94 PTGS1 (0.70) PTGS1GSTK1GLO1NOD1KMT2A
Glutathione Ethyl Ester SCHEMBL7529967 0.89 PTGS1 (0.54) PTGS1GSTK1GLO1NOD1FNTA
Glutathione Ethyl Ester SCHEMBL7523000 0.89 PTGS1 (0.54) PTGS1GSTK1GLO1NOD1FNTA
SCHEMBL19293518 0.88 PTGS1 (0.59) PTGS1GSTK1GLO1NOD1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0806432-B1 Glutathione monoester sulfonate KYOWA HAKKO KOGYO KK (JP) 2002-03-20 EP disclosed
US-5756823-A Glutathione monoester sulfonate KYOWA HAKKO KOGYO CO., LTD. (JP) 1998-05-26 US disclosed
EP-0806432-A1 Glutathione monoester sulfonate KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-11-12 EP disclosed