Literature summary for 3.1.3.1 extracted from

Jafari, B.; Ospanov, M.; Ejaz, S.A.; Yelibayeva, N.; Khan, S.U.; Amjad, S.T.; Safarov, S.; Abilov, Z.A.; Turmukhanova, M.Z.; Kalugin, S.N.; Ehlers, P.; Lecka, J.; Sevigny, J.; Iqbal, J.; Langer, P.
2-Substituted 7-trifluoromethyl-thiadiazolopyrimidones as alkaline phosphatase inhibitors. Synthesis, structure activity relationship and molecular docking study (2018), Eur. J. Med. Chem., 144, 116-127 .

Inhibitors

Inhibitors	Comment	Organism
2-(1-methylhydrazenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(2-ethoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(2-fluorophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(2-methoxyphenyl)-7- trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3,4-di-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3,5-di-methoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3,5-di-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3-cyanophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3-fluoromethylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3-fluorophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3-methoxyphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3-nitrophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(3-phenylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-aminophenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-ethoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-ethoxyphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-ethylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-i-propylphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-methoxylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-(4-trifluoromethoxylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-allylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-di-n-butylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-n-butylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-n-pentylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-n-propylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-phenyl-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
2-[2-(dimethylamino)ethyl]amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one	-	Homo sapiens
L-phenylalanine	inhibitor of intestinal alkaline phosphatase	Homo sapiens
levamisole	inhibitor of tissue non-specific alkaline phosphatase	Homo sapiens

Organism

Organism	UniProt	Comment	Textmining
Homo sapiens	P09487	-	-
Homo sapiens	P19111	-	-

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
4-nitrophenyl phosphate + H2O	-	Homo sapiens	4-nitrophenol + phosphate	-	?

Synonyms

Synonyms	Comment	Organism
IAP	-	Homo sapiens
intestinal alkaline phosphatase	-	Homo sapiens
tissue non-specific alkaline phosphatase	-	Homo sapiens
TNAP	-	Homo sapiens

IC50 Value

IC50 Value	IC50 Value Maximum	Comment	Organism	Inhibitor
0.00021	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-phenyl-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00024	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-trifluoromethoxylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00028	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-methoxylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00029	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-allylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00031	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-n-propylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00033	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-aminophenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00036	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00038	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-methoxyphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00043	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-phenyl-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00044	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-methoxyphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00045	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-[2-(dimethylamino)ethyl]amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00046	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3,5-di-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00048	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-nitrophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00048	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-methoxylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00052	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3,5-di-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00052	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-fluoromethylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00054	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3,4-di-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00056	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-cyanophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00061	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-n-pentylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00062	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-nitrophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00068	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-fluoromethylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00071	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-aminophenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00071	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-n-butylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00074	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-fluorophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00076	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3,5-di-methoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00076	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-n-pentylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00079	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-ethoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00088	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-n-butylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00089	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-allylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00093	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-ethoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00106	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00112	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-cyanophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00112	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-phenylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00115	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3,5-di-methoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00139	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-fluorophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00144	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-n-propylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00153	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-di-n-butylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00158	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-ethoxyphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00167	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3-phenylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00175	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(3,4-di-methylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00198	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-i-propylphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00202	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-ethoxyphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00202	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(1-methylhydrazenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00222	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(1-methylhydrazenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00348	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(2-methoxyphenyl)-7- trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00375	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-[2-(dimethylamino)ethyl]amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00452	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(2-ethoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00455	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-ethylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.00463	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-di-n-butylamino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.0192	-	tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	levamisole
0.0315	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-i-propylphenyl)amino-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.0802	-	intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	L-phenylalanine
0.1	-	IC50 above 0.1 mM, intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(2-ethoxyphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.1	-	IC50 above 0.1 mM, intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(2-fluorophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.1	-	IC50 above 0.1 mM, intestinal alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(2-methoxyphenyl)-7- trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.1	-	IC50 above 0.1 mM, tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(2-fluorophenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.1	-	IC50 above 0.1 mM, tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-ethylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
0.1	-	IC50 above 0.1 mM, tissue non-specific alkaline phosphatase, at 37°C, pH not specified in the publication	Homo sapiens	2-(4-trifluoromethoxylphenyl)-7-trifluoromethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one