Literature summary for 3.2.1.52 extracted from

Tropak, M.B.; Blanchard, J.E.; Withers, S.G.; Brown, E.D.; Mahuran, D.
High-throughput screening for human lysosomal beta-N-acetyl hexosaminidase inhibitors acting as pharmacological chaperones (2007), Chem. Biol., 14, 153-164.

Inhibitors

Inhibitors	Comment	Organism
(1Z)-2-nitro-1H-indene-1,3(2H)-dione oxime	-	Homo sapiens
(2E)-3-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(2-thienylcarbonyl)acrylonitrile	-	Homo sapiens
(3E)-1-methyl-3-([[3-(trifluoromethyl)phenyl]amino]methylene)-1H-thieno[3,2-c][1,2]thiazin-4(3H)-one 2,2-dioxide	-	Homo sapiens
1,1'-(1,3-dioxo-2-phenylpropane-1,3-diyl)bis(2,3-dihydro-1H-indole)	-	Homo sapiens
1-[2-(1H-benzimidazol-2-yl)phenyl]-3-[4-(benzyloxy)phenyl]urea	-	Homo sapiens
1-[5-acetyl-2-[4-(ethoxycarbonyl)piperidin-1-yl]phenyl]-1-methyldiazenium	-	Homo sapiens
2,2'-(iminodiethane-2,1-diyl)bis(1H-benzo[de]isoquinoline-1,3(2H)-dione)	-	Homo sapiens
2-(2-hydroxypropyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione	-	Homo sapiens
2-(2-pyridin-2-ylethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione	-	Homo sapiens
2-(4-chlorobenzyl)-5-methyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one	-	Homo sapiens
2-(tetrahydrofuran-2-ylmethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione	-	Homo sapiens
2-amino-6-(methoxymethyl)pyrimidin-4-ol	-	Homo sapiens
2-hydroxy-3-phenyl-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one	-	Homo sapiens
3,5-bis(4-fluorophenyl)-1-phenyl-4,5-dihydro-1H-pyrazole	-	Homo sapiens
3-methoxy-1-(3,4,5-trimethoxyphenyl)-9,10-dihydrophenanthrene-2-carbonitrile	-	Homo sapiens
3-[2-(benzyloxy)-5-fluorophenyl]-5-(4-tert-butylphenyl)-1-(2,4-dichlorophenyl)-4,5-dihydro-1H-pyrazole	-	Homo sapiens
4,5-dihydronaphtho[1,2-b]thiophene-2-carbohydrazide	-	Homo sapiens
4-hydroxy-3-(methylthio)-N'-[(1E)-2-thienylmethylene]-4,5,6,7-tetrahydro-2-benzothiophene-1-carbohydrazide	-	Homo sapiens
4-[(E)-2-phenylvinyl]benzaldehyde O-(anilinocarbonyl)oxime	-	Homo sapiens
4-[4-(phenylethynyl)phenyl]-N-[4-(trifluoromethoxy)phenyl]butanamide	-	Homo sapiens
5-(3-nitrophenyl)-2-furaldehyde N-(3-fluorophenyl)thiosemicarbazone	-	Homo sapiens
5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4,5-dihydro-1,3,4-thiadiazole-2-thiol	-	Homo sapiens
ethyl 3-(N-[[(4-chlorophenyl)amino]carbonyl]-S-methylsulfinimidoyl)-6,7-dihydro-2-benzothiophene-1-carboxylate	-	Homo sapiens
ethyl 5-[[3-(trifluoromethyl)phenyl]amino]pyrazolo[1,5-a]quinazoline-3-carboxylate	-	Homo sapiens
N-(3,5-dichlorophenyl)-2-[[4-(3,4-dimethylthieno[2,3-b]thien-2-yl)pyrimidin-2-yl]thio]acetamide	-	Homo sapiens
naphthalene-1,4-diyl bis(trifluoroacetate)	-	Homo sapiens
S-(thiophen-3-ylmethyl) (2,2'-bithiophen-5-ylcarbonyl)thiocarbamate	-	Homo sapiens

Localization

Localization	Comment	Organism	GeneOntology No.	Textmining

Organism

Organism	UniProt	Comment	Textmining
Homo sapiens	-	-	-

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
4-methylumbelliferyl-beta-N-acetylglucosamine + H2O	-	Homo sapiens	4-methylumbelliferone + beta-N-acetylglucosamine	-	?

Synonyms

Synonyms	Comment	Organism
beta-hexosaminidase A	-	Homo sapiens
hHexA	-	Homo sapiens

IC50 Value

IC50 Value	IC50 Value Maximum	Comment	Organism	Inhibitor
0.0002	-	-	Homo sapiens	2,2'-(iminodiethane-2,1-diyl)bis(1H-benzo[de]isoquinoline-1,3(2H)-dione)
0.0018	-	-	Homo sapiens	(1Z)-2-nitro-1H-indene-1,3(2H)-dione oxime
0.0058	-	-	Homo sapiens	2-(4-chlorobenzyl)-5-methyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
0.0065	-	-	Homo sapiens	3,5-bis(4-fluorophenyl)-1-phenyl-4,5-dihydro-1H-pyrazole
0.012	-	-	Homo sapiens	1-[2-(1H-benzimidazol-2-yl)phenyl]-3-[4-(benzyloxy)phenyl]urea
0.02	-	-	Homo sapiens	N-(3,5-dichlorophenyl)-2-[[4-(3,4-dimethylthieno[2,3-b]thien-2-yl)pyrimidin-2-yl]thio]acetamide
0.024	-	-	Homo sapiens	4,5-dihydronaphtho[1,2-b]thiophene-2-carbohydrazide
0.029	-	-	Homo sapiens	S-(thiophen-3-ylmethyl) (2,2'-bithiophen-5-ylcarbonyl)thiocarbamate
0.03	-	-	Homo sapiens	4-hydroxy-3-(methylthio)-N'-[(1E)-2-thienylmethylene]-4,5,6,7-tetrahydro-2-benzothiophene-1-carbohydrazide
0.031	-	-	Homo sapiens	2-(2-hydroxypropyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
0.034	-	-	Homo sapiens	1,1'-(1,3-dioxo-2-phenylpropane-1,3-diyl)bis(2,3-dihydro-1H-indole)
0.035	-	-	Homo sapiens	3-methoxy-1-(3,4,5-trimethoxyphenyl)-9,10-dihydrophenanthrene-2-carbonitrile
0.039	-	-	Homo sapiens	ethyl 3-(N-[[(4-chlorophenyl)amino]carbonyl]-S-methylsulfinimidoyl)-6,7-dihydro-2-benzothiophene-1-carboxylate
0.042	-	-	Homo sapiens	(2E)-3-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(2-thienylcarbonyl)acrylonitrile
0.042	-	-	Homo sapiens	5-(3-nitrophenyl)-2-furaldehyde N-(3-fluorophenyl)thiosemicarbazone
0.044	-	-	Homo sapiens	2-amino-6-(methoxymethyl)pyrimidin-4-ol
0.045	-	-	Homo sapiens	ethyl 5-[[3-(trifluoromethyl)phenyl]amino]pyrazolo[1,5-a]quinazoline-3-carboxylate
0.065	-	-	Homo sapiens	1-[5-acetyl-2-[4-(ethoxycarbonyl)piperidin-1-yl]phenyl]-1-methyldiazenium
0.071	-	-	Homo sapiens	4-[4-(phenylethynyl)phenyl]-N-[4-(trifluoromethoxy)phenyl]butanamide
0.072	-	-	Homo sapiens	2-hydroxy-3-phenyl-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
0.079	-	-	Homo sapiens	5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4,5-dihydro-1,3,4-thiadiazole-2-thiol
0.093	-	-	Homo sapiens	naphthalene-1,4-diyl bis(trifluoroacetate)
0.108	-	-	Homo sapiens	2-(2-pyridin-2-ylethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
0.138	-	-	Homo sapiens	2-(tetrahydrofuran-2-ylmethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
0.162	-	-	Homo sapiens	3-[2-(benzyloxy)-5-fluorophenyl]-5-(4-tert-butylphenyl)-1-(2,4-dichlorophenyl)-4,5-dihydro-1H-pyrazole
0.18	-	-	Homo sapiens	4-[(E)-2-phenylvinyl]benzaldehyde O-(anilinocarbonyl)oxime
0.27	-	-	Homo sapiens	(3E)-1-methyl-3-([[3-(trifluoromethyl)phenyl]amino]methylene)-1H-thieno[3,2-c][1,2]thiazin-4(3H)-one 2,2-dioxide