Thioglycolic Acid

Thioglycolic Acid

SCHEMBL4737828

O=C([O-])CS.O=C([O-])CS.[K+].[K+]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA

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

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA4 P22748 6/20 0.47
FAHD1 Q6P587 1/20 0.43
CASP1 P29466 1/20 0.41
FFAR3 O14843 2/20 0.37
HDAC3 O15379 2/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
MEN1 O00255 1/20 0.35
LDHA P00338 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 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
Thioglycolic Acid SCHEMBL59723 1.00
Thioglycolic Acid SCHEMBL10953591 0.93
Thioglycolic Acid SCHEMBL11582067 0.92 CA4 (0.47) CA4FAHD1CASP1FFAR3HDAC3
Thioglycolic Acid SCHEMBL692043 0.92 CA4 (0.47) CA4FAHD1CASP1FFAR3HDAC3
Thioglycolic Acid SCHEMBL10895895 0.92 CA4 (0.53) CA4FAHD1CASP1FFAR3HDAC3
Thioglycolic Acid SCHEMBL4274828 0.92
Thioglycolic Acid SCHEMBL216244 0.92 CA4 (0.47) CA4FAHD1CASP1FFAR3HDAC3
Thioglycolic Acid SCHEMBL8897741 0.92 CA4 (0.47) CA4FAHD1CASP1FFAR3HDAC3
Thioglycolic Acid SCHEMBL16760982 0.92 CA4 (0.47) CA4FAHD1CASP1FFAR3HDAC3
Thioglycolic Acid SCHEMBL156458 0.92 CA4 (0.47) CA4FAHD1CASP1FFAR3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008073434-A1 DEPILATORY COMPOSITIONS HAVING HIGH CONCENTRATIONS OF ALKALI METAL IONS MCNEIL-PPC, INC. (US) 2008-06-19 WO disclosed
US-20080138304-A1 DEPILATORY COMPOSITIONS HAVING HIGH CONCENTRATIONS OF ALKALI METAL IONS MCNEIL-PPC, INC. 2008-06-12 US disclosed
EP-1001735-B1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT BENCKISER FRANCE (FR) 2003-03-19 EP disclosed
EP-0973490-B1 DEPILATORY COMPOSITIONS, THEIR PREPARATION AND USE RECKITT BENCKISER FRANCE (FR) 2003-02-26 EP disclosed
US-6306380-B1 FOR REMOVING UNWANTED BODY HAIR RECKITT & COLMAN FRANCE (FR) 2001-10-23 US disclosed
EP-1001735-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE Reckitt & Colman France (FR) 2000-05-24 EP disclosed
EP-0973490-A1 DEPILATORY COMPOSITIONS, THEIR PREPARATION AND USE RECKITT & COLMAN FRANCE (FR) 2000-01-26 EP disclosed
WO-1999002125-A1 DEPILATORY COMPOSITIONS, METHODS FOR THEIR PREPARATION AND THEIR USE RECKITT & COLMAN FRANCE (FR) 1999-01-21 WO disclosed
WO-1998044898-A1 DEPILATORY COMPOSITIONS, THEIR PREPARATION AND USE RECKITT & COLMAN FRANCE (FR) 1998-10-15 WO disclosed