Inhibitors | Comment | Organism | Structure |
---|---|---|---|
4-(4-chlorobenzamido)phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | - |
Homo sapiens | |
4-(4-chlorobenzamido)phenyl 4-(trifluoromethyl)benzene-1-sulfonate | - |
Homo sapiens | |
4-(4-chlorobenzamido)phenyl 4-fluorobenzene-1-sulfonate | 46% inhibition at 0.1 mM | Homo sapiens | |
4-(4-chlorobenzamido)phenyl 4-methylbenzene-1-sulfonate | - |
Homo sapiens | |
4-(4-chlorobenzamido)phenyl 4-tert-butylbenzene-1-sulfonate | - |
Homo sapiens | |
4-(4-chlorobenzamido)phenyl benzenesulfonate | - |
Homo sapiens | |
4-[(cycloheptanecarbonyl)amino]phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | 29% inhibition at 0.1 mM; 37% inhibition at 0.1 mM | Homo sapiens | |
4-[(cycloheptanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | - |
Homo sapiens | |
4-[(cycloheptanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | 39.3% inhibition at 0.1 mM | Homo sapiens | |
4-[(cycloheptanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cycloheptanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cycloheptanecarbonyl)amino]phenyl benzenesulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | 39% inhibition at 0.1 mM+L345; 43% inhibition at 0.1 mM | Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl benzenesulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl ethanesulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl methanesulfonate | - |
Homo sapiens | |
4-[(cyclohexanecarbonyl)amino]phenyl propane-1-sulfonate | - |
Homo sapiens | |
4-[(cyclooctanecarbonyl)amino]phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | 30% inhibition at 0.1 mM; 30% inhibition at 0.1 mM | Homo sapiens | |
4-[(cyclooctanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | 29% inhibition at 0.1 mM | Homo sapiens | |
4-[(cyclooctanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | 35% inhibition at 0.1 mM; 43% inhibition at 0.1 mM | Homo sapiens | |
4-[(cyclooctanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | 40% inhibition at 0.1 mM; 46% inhibition at 0.1 mM | Homo sapiens | |
4-[(cyclooctanecarbonyl)amino]phenyl benzenesulfonate | 45% inhibition at 0.1 mM; 47% inhibition at 0.1 mM | Homo sapiens | |
4-[(cyclopentanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclopentanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclopentanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclopentanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | - |
Homo sapiens | |
4-[(cyclopentanecarbonyl)amino]phenyl benzenesulfonate | - |
Homo sapiens | |
4-[(naphthalene-2-carbonyl)amino]phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | - |
Homo sapiens | |
4-[(naphthalene-2-carbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | - |
Homo sapiens | |
4-[(naphthalene-2-carbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | - |
Homo sapiens | |
4-[(naphthalene-2-carbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | 49% inhibition at 0.1 mM | Homo sapiens | |
4-[(naphthalene-2-carbonyl)amino]phenyl benzenesulfonate | 23% inhibition at 0.1 mM; 24% inhibition at 0.1 mM | Homo sapiens | |
4-[(quinoline-8-carbonyl)amino]phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | 37% inhibition at 0.1 mM; 42% inhibition at 0.1 mM | Homo sapiens | |
additional information | synthesis, biological evaluation, and molecular docking study of sulfonate derivatives as nucleotide pyrophosphatase/phosphodiesterase (NPP) inhibitors, structure-activity relationships, molecular docking study and analysis, overview; synthesis, biological evaluation, and molecular docking study of sulfonate derivatives as nucleotide pyrophosphatase/phosphodiesterase (NPP) inhibitors, structure-activity relationships, molecular docking study and analysis, overview | Homo sapiens |
Metals/Ions | Comment | Organism | Structure |
---|---|---|---|
Mg2+ | required | Homo sapiens |
Natural Substrates | Organism | Comment (Nat. Sub.) | Natural Products | Comment (Nat. Pro.) | Rev. | Reac. |
---|---|---|---|---|---|---|
ATP + H2O | Homo sapiens | - |
ADP + phosphate | - |
? |
Organism | UniProt | Comment | Textmining |
---|---|---|---|
Homo sapiens | O14638 | - |
- |
Homo sapiens | P22413 | - |
- |
Substrates | Comment Substrates | Organism | Products | Comment (Products) | Rev. | Reac. |
---|---|---|---|---|---|---|
ATP + H2O | - |
Homo sapiens | ADP + phosphate | - |
? |
Synonyms | Comment | Organism |
---|---|---|
CD203c | - |
Homo sapiens |
ENPP1 | - |
Homo sapiens |
ENPP3 | - |
Homo sapiens |
h-NPP1 | - |
Homo sapiens |
h-NPP3 | - |
Homo sapiens |
NPP | - |
Homo sapiens |
NPP1 | - |
Homo sapiens |
NPP3 | - |
Homo sapiens |
nucleotide pyrophosphatase/phosphodiesterase | - |
Homo sapiens |
Temperature Optimum [°C] | Temperature Optimum Maximum [°C] | Comment | Organism |
---|---|---|---|
37 | - |
assay at | Homo sapiens |
pH Optimum Minimum | pH Optimum Maximum | Comment | Organism |
---|---|---|---|
9.5 | - |
assay at | Homo sapiens |
IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
---|---|---|---|---|---|
0.000214 | - |
pH 9.5, 37°C, NPP26 | Homo sapiens | 4-[(cyclooctanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.000254 | - |
pH 9.5, 37°C, NPP14 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.000255 | - |
pH 9.5, 37°C, NPP17 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | |
0.000369 | - |
pH 9.5, 37°C, NPP9 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl ethanesulfonate | |
0.000387 | - |
pH 9.5, 37°C, NPP13 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.000422 | - |
pH 9.5, 37°C, NPP15 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | |
0.000431 | - |
pH 9.5, 37°C, NPP19 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.000564 | - |
pH 9.5, 37°C, NPP12 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.000807 | - |
pH 9.5, 37°C, NPP13 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | |
0.000856 | - |
pH 9.5, 37°C, NPP4 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | |
0.000975 | - |
pH 9.5, 37°C, NPP28 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | |
0.001014 | - |
pH 9.5, 37°C, NPP6 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.001079 | - |
pH 9.5, 37°C, NPP11 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl benzenesulfonate | |
0.001118 | - |
pH 9.5, 37°C, NPP36 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.001134 | - |
pH 9.5, 37°C, NPP5 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.001203 | - |
pH 9.5, 37°C, NPP30 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | |
0.001354 | - |
pH 9.5, 37°C, NPP8 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl methanesulfonate | |
0.001437 | - |
pH 9.5, 37°C, NPP26 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-methylbenzene-1-sulfonate | |
0.001487 | - |
pH 9.5, 37°C, NPP35 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.001493 | - |
pH 9.5, 37°C, NPP16 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | |
0.001525 | - |
pH 9.5, 37°C, NPP29 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-tert-butylbenzene-1-sulfonate | |
0.001624 | - |
pH 9.5, 37°C, NPP28 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-methylbenzene-1-sulfonate | |
0.001629 | - |
pH 9.5, 37°C, NPP7 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl ethanesulfonate | |
0.001648 | - |
pH 9.5, 37°C, NPP3 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | |
0.001724 | - |
pH 9.5, 37°C, NPP3 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl benzenesulfonate | |
0.00179 | - |
pH 9.5, 37°C, NPP15 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.001799 | - |
pH 9.5, 37°C, NPP27 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-tert-butylbenzene-1-sulfonate | |
0.001918 | - |
pH 9.5, 37°C, NPP6 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl methanesulfonate | |
0.002195 | - |
pH 9.5, 37°C, NPP33 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | |
0.002267 | - |
pH 9.5, 37°C, NPP20 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.002409 | - |
pH 9.5, 37°C, NPP10 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl propane-1-sulfonate | |
0.00255 | - |
pH 9.5, 37°C, NPP11 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | |
0.002578 | - |
pH 9.5, 37°C, NPP21 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.002675 | - |
pH 9.5, 37°C, NPP5 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate | |
0.002772 | - |
pH 9.5, 37°C, NPP27 | Homo sapiens | 4-(4-chlorobenzamido)phenyl benzenesulfonate | |
0.002892 | - |
pH 9.5, 37°C, NPP36 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | |
0.002897 | - |
pH 9.5, 37°C, NPP29 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-fluorobenzene-1-sulfonate | |
0.003424 | - |
pH 9.5, 37°C, NPP32 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.003429 | - |
pH 9.5, 37°C, NPP34 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate | |
0.003461 | - |
pH 9.5, 37°C, NPP8 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl propane-1-sulfonate | |
0.003963 | - |
pH 9.5, 37°C, NPP7 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.005426 | - |
pH 9.5, 37°C, NPP38 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.00576 | - |
pH 9.5, 37°C, NPP4 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.006602 | - |
pH 9.5, 37°C, NPP16 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl benzenesulfonate | |
0.008137 | - |
pH 9.5, 37°C, NPP2 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl 4-methylbenzene-1-sulfonate | |
0.009296 | - |
pH 9.5, 37°C, NPP31 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl benzenesulfonate | |
0.009614 | - |
pH 9.5, 37°C, NPP25 | Homo sapiens | 4-(4-chlorobenzamido)phenyl benzenesulfonate | |
0.01185 | - |
pH 9.5, 37°C, NPP9 | Homo sapiens | 4-[(cyclohexanecarbonyl)amino]phenyl benzenesulfonate | |
0.01352 | - |
pH 9.5, 37°C, NPP37 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl 4-fluorobenzene-1-sulfonate | |
0.01384 | - |
pH 9.5, 37°C, NPP14 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl benzenesulfonate | |
0.02051 | - |
pH 9.5, 37°C, NPP33 | Homo sapiens | 4-[(naphthalene-2-carbonyl)amino]phenyl benzenesulfonate | |
0.02157 | - |
pH 9.5, 37°C, NPP30 | Homo sapiens | 4-(4-chlorobenzamido)phenyl 4-(trifluoromethyl)benzene-1-sulfonate | |
0.04667 | - |
pH 9.5, 37°C, NPP1 | Homo sapiens | 4-[(cyclopentanecarbonyl)amino]phenyl benzenesulfonate | |
0.04701 | - |
pH 9.5, 37°C, NPP18 | Homo sapiens | 4-[(cycloheptanecarbonyl)amino]phenyl 4-tert-butylbenzene-1-sulfonate |