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Compile Data Set for Download or QSAR

Found 120 hits of ic50 data for polymerid = 9340   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50433370
PNG
(CHEMBL2375482)
Show SMILES Brc1ccc(cc1)-c1nnc2sc(nn12)-c1ccoc1
Show InChI InChI=1S/C13H7BrN4OS/c14-10-3-1-8(2-4-10)11-15-16-13-18(11)17-12(20-13)9-5-6-19-7-9/h1-7H
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n/an/a 61n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate incubated for 10 mins prior to substrate addition measured after 30 mins ...


Eur J Med Chem 63: 854-68 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.060
BindingDB Entry DOI: 10.7270/Q2222W47
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222258
PNG
((Z)-4-(2-((E)-4-(2-chlorophenyl)-1-morpholino-2-ox...)
Show SMILES NS(=O)(=O)c1ccc(N\N=C(/N2CCOCC2)C(=O)\C=C\c2ccccc2Cl)cc1
Show InChI InChI=1S/C20H21ClN4O4S/c21-18-4-2-1-3-15(18)5-10-19(26)20(25-11-13-29-14-12-25)24-23-16-6-8-17(9-7-16)30(22,27)28/h1-10,23H,11-14H2,(H2,22,27,28)/b10-5+,24-20-
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n/an/a 120n/an/an/an/a9.837



COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50068225
PNG
(CHEMBL3403324)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C14H16N2O4S2/c1-11-2-6-14(7-3-11)22(19,20)16-10-12-4-8-13(9-5-12)21(15,17)18/h2-9,16H,10H2,1H3,(H2,15,17,18)
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n/an/a 140n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275870
PNG
(CHEMBL4129331)
Show SMILES Clc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Show InChI InChI=1S/C18H14ClN5O3S2/c19-13-4-2-12(3-5-13)16(25)23-18(28)22-14-6-8-15(9-7-14)29(26,27)24-17-20-10-1-11-21-17/h1-11H,(H,20,21,24)(H2,22,23,25,28)
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n/an/a 251n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275871
PNG
(CHEMBL4128234)
Show SMILES Clc1ccc(C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)Nc2ncccn2)c(Cl)c1
Show InChI InChI=1S/C18H13Cl2N5O3S2/c19-11-2-7-14(15(20)10-11)16(26)24-18(29)23-12-3-5-13(6-4-12)30(27,28)25-17-21-8-1-9-22-17/h1-10H,(H,21,22,25)(H2,23,24,26,29)
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n/an/a 344n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222262
PNG
((Z)-4-(2-((E)-4-(3,4-dimethoxyphenyl)-1-morpholino...)
Show SMILES COc1ccc(\C=C\C(=O)C(=N\Nc2ccc(cc2)S(N)(=O)=O)\N2CCOCC2)cc1OC
Show InChI InChI=1S/C22H26N4O6S/c1-30-20-10-4-16(15-21(20)31-2)3-9-19(27)22(26-11-13-32-14-12-26)25-24-17-5-7-18(8-6-17)33(23,28)29/h3-10,15,24H,11-14H2,1-2H3,(H2,23,28,29)/b9-3+,25-22-
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n/an/a 350n/an/an/an/a9.837



COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222185
PNG
(6-(Dimethylamino)-3-(3',5'-dichloro-2-hydr...)
Show SMILES CN(C)c1ccc2C(NS(=O)(=O)c3cccc1c23)c1cc(Cl)cc(Cl)c1O
Show InChI InChI=1S/C19H16Cl2N2O3S/c1-23(2)15-7-6-12-17-11(15)4-3-5-16(17)27(25,26)22-18(12)13-8-10(20)9-14(21)19(13)24/h3-9,18,22,24H,1-2H3
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n/an/a 380n/an/an/an/a9.837



University of Karachi



Assay Description
Alkaline phosphatase (b-TNAP, c-IAP purchased from Calzyme Laboratories, Inc. USA) inhibition assay of different cyclic sulfonamides was performed us...


Bioorg Chem 71: 10-18 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.008
BindingDB Entry DOI: 10.7270/Q26Q1W36
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50068218
PNG
(CHEMBL3403318)
Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2)cc1
Show InChI InChI=1S/C15H16N2O3S/c16-21(19,20)14-8-6-12(7-9-14)10-11-17-15(18)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,17,18)(H2,16,19,20)
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Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222264
PNG
((Z)-4-(2-((E)-4-(2-fluorophenyl)-1-morpholino-2-ox...)
Show SMILES NS(=O)(=O)c1ccc(N\N=C(/N2CCOCC2)C(=O)\C=C\c2ccccc2F)cc1
Show InChI InChI=1S/C20H21FN4O4S/c21-18-4-2-1-3-15(18)5-10-19(26)20(25-11-13-29-14-12-25)24-23-16-6-8-17(9-7-16)30(22,27)28/h1-10,23H,11-14H2,(H2,22,27,28)/b10-5+,24-20-
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COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275925
PNG
(CHEMBL4130271)
Show SMILES CCCCCCC(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Show InChI InChI=1S/C18H23N5O3S2/c1-2-3-4-5-7-16(24)22-18(27)21-14-8-10-15(11-9-14)28(25,26)23-17-19-12-6-13-20-17/h6,8-13H,2-5,7H2,1H3,(H,19,20,23)(H2,21,22,24,27)
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n/an/a 492n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50165143
PNG
(CHEMBL3798555)
Show SMILES CC(C)OC1Oc2ccccc2C(=O)\C1=C/Nc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C19H20N2O5S/c1-12(2)25-19-16(18(22)15-5-3-4-6-17(15)26-19)11-21-13-7-9-14(10-8-13)27(20,23)24/h3-12,19,21H,1-2H3,(H2,20,23,24)/b16-11+
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n/an/a 527n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase preincubated for 3 to 5 mins followed by CDP-star substrate addition measured after 15 mins by lum...


Eur J Med Chem 115: 484-94 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.073
BindingDB Entry DOI: 10.7270/Q2K939D7
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50165128
PNG
(CHEMBL3799629)
Show SMILES COC1Oc2ccccc2C(=O)\C1=C/Nc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N2O5S/c1-23-17-14(16(20)13-4-2-3-5-15(13)24-17)10-19-11-6-8-12(9-7-11)25(18,21)22/h2-10,17,19H,1H3,(H2,18,21,22)/b14-10+
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Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase preincubated for 3 to 5 mins followed by CDP-star substrate addition measured after 15 mins by lum...


Eur J Med Chem 115: 484-94 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.073
BindingDB Entry DOI: 10.7270/Q2K939D7
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM223071
PNG
((E)-N'-(4'-Chlorobenzylidene)isonicotinohy...)
Show SMILES Clc1ccc(\C=N\NC(=O)c2ccncc2)cc1
Show InChI InChI=1S/C13H10ClN3O/c14-12-3-1-10(2-4-12)9-16-17-13(18)11-5-7-15-8-6-11/h1-9H,(H,17,18)/b16-9+
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n/an/a 670n/an/an/an/a9.837



Quaid-I-Azam University



Assay Description
The assay conditions were optimized with some changes in formerly reported spectrophotometric method. The composition of assay buffer of pH 9.8 was a...


Chem Biol Drug Des 89: 365-370 (2017)


Article DOI: 10.1111/cbdd.12861
BindingDB Entry DOI: 10.7270/Q2F47N10
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222259
PNG
((Z)-4-(2-((E)-4-(2,4-dichlorophenyl)-1-morpholino-...)
Show SMILES NS(=O)(=O)c1ccc(N\N=C(/N2CCOCC2)C(=O)\C=C\c2ccc(Cl)cc2Cl)cc1
Show InChI InChI=1S/C20H20Cl2N4O4S/c21-15-3-1-14(18(22)13-15)2-8-19(27)20(26-9-11-30-12-10-26)25-24-16-4-6-17(7-5-16)31(23,28)29/h1-8,13,24H,9-12H2,(H2,23,28,29)/b8-2+,25-20-
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n/an/a 680n/an/an/an/a9.837



COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50068232
PNG
(CHEMBL3403328)
Show SMILES CCOc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C14H14FNO3S/c1-2-19-13-7-5-12(6-8-13)16-20(17,18)14-9-3-11(15)4-10-14/h3-10,16H,2H2,1H3
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n/an/a 720n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222265
PNG
((Z)-4-(2-((E)-4-(3-fluorophenyl)-1-morpholino-2-ox...)
Show SMILES NS(=O)(=O)c1ccc(N\N=C(/N2CCOCC2)C(=O)\C=C\c2cccc(F)c2)cc1
Show InChI InChI=1S/C20H21FN4O4S/c21-16-3-1-2-15(14-16)4-9-19(26)20(25-10-12-29-13-11-25)24-23-17-5-7-18(8-6-17)30(22,27)28/h1-9,14,23H,10-13H2,(H2,22,27,28)/b9-4+,24-20-
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COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222267
PNG
((Z)-4-(2-((E)-1-morpholino-4-(3-Nitrophenyl)-2-oxo...)
Show SMILES NS(=O)(=O)c1ccc(N\N=C(/N2CCOCC2)C(=O)\C=C\c2cccc(c2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C20H21N5O6S/c21-32(29,30)18-7-5-16(6-8-18)22-23-20(24-10-12-31-13-11-24)19(26)9-4-15-2-1-3-17(14-15)25(27)28/h1-9,14,22H,10-13H2,(H2,21,29,30)/b9-4+,23-20-
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COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275869
PNG
(CHEMBL4126012)
Show SMILES [O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Show InChI InChI=1S/C18H13N7O7S2/c26-16(11-8-13(24(27)28)10-14(9-11)25(29)30)22-18(33)21-12-2-4-15(5-3-12)34(31,32)23-17-19-6-1-7-20-17/h1-10H,(H,19,20,23)(H2,21,22,26,33)
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n/an/a 896n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50004306
PNG
(CHEMBL3237531)
Show SMILES Fc1cc(Cl)ccc1-c1nn2c(nnc2s1)-c1ccncc1
Show InChI InChI=1S/C14H7ClFN5S/c15-9-1-2-10(11(16)7-9)13-20-21-12(18-19-14(21)22-13)8-3-5-17-6-4-8/h1-7H
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n/an/a 920n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-nitrophenyl phosphate as substrate preincubated for 10 mins before substrate addition afte...


Eur J Med Chem 78: 167-77 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.046
BindingDB Entry DOI: 10.7270/Q2F76F32
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222260
PNG
((Z)-4-(2-((E)-4-(3-methoxyphenyl)-1-morpholino-2-o...)
Show SMILES COc1cccc(\C=C\C(=O)C(=N\Nc2ccc(cc2)S(N)(=O)=O)\N2CCOCC2)c1
Show InChI InChI=1S/C21H24N4O5S/c1-29-18-4-2-3-16(15-18)5-10-20(26)21(25-11-13-30-14-12-25)24-23-17-6-8-19(9-7-17)31(22,27)28/h2-10,15,23H,11-14H2,1H3,(H2,22,27,28)/b10-5+,24-21-
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COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234715
PNG
(CHEMBL4069497)
Show SMILES COc1ccc(cc1)-c1c([nH]c2ccc(N)cc2c1=O)-c1ccc(C)cc1
Show InChI InChI=1S/C23H20N2O2/c1-14-3-5-16(6-4-14)22-21(15-7-10-18(27-2)11-8-15)23(26)19-13-17(24)9-12-20(19)25-22/h3-13H,24H2,1-2H3,(H,25,26)
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n/an/a 1.06E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222179
PNG
(6-(Dimethylamino)-3-phenyl-2,3-dihydronaphtho[1,8-...)
Show SMILES CN(C)c1ccc2C(NS(=O)(=O)c3cccc1c23)c1ccccc1
Show InChI InChI=1S/C19H18N2O2S/c1-21(2)16-12-11-15-18-14(16)9-6-10-17(18)24(22,23)20-19(15)13-7-4-3-5-8-13/h3-12,19-20H,1-2H3
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n/an/a 1.12E+3n/an/an/an/a9.837



University of Karachi



Assay Description
Alkaline phosphatase (b-TNAP, c-IAP purchased from Calzyme Laboratories, Inc. USA) inhibition assay of different cyclic sulfonamides was performed us...


Bioorg Chem 71: 10-18 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.008
BindingDB Entry DOI: 10.7270/Q26Q1W36
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM16661
PNG
(1-N-(4-fluorobenzene)benzene-1,4-disulfonamide | a...)
Show SMILES NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C12H11FN2O4S2/c13-9-1-5-12(6-2-9)21(18,19)15-10-3-7-11(8-4-10)20(14,16)17/h1-8,15H,(H2,14,16,17)
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n/an/a 1.13E+3n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50068220
PNG
(CHEMBL3403320)
Show SMILES NS(=O)(=O)c1ccc(CNC(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C14H13FN2O3S/c15-12-5-3-11(4-6-12)14(18)17-9-10-1-7-13(8-2-10)21(16,19)20/h1-8H,9H2,(H,17,18)(H2,16,19,20)
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n/an/a 1.18E+3n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222266
PNG
((Z)-4-(2-((E)-4-(2-bromophenyl)-1-morpholino-2-oxo...)
Show SMILES NS(=O)(=O)c1ccc(N\N=C(/N2CCOCC2)C(=O)\C=C\c2ccccc2Br)cc1
Show InChI InChI=1S/C20H21BrN4O4S/c21-18-4-2-1-3-15(18)5-10-19(26)20(25-11-13-29-14-12-25)24-23-16-6-8-17(9-7-16)30(22,27)28/h1-10,23H,11-14H2,(H2,22,27,28)/b10-5+,24-20-
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n/an/a 1.21E+3n/an/an/an/a9.837



COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50068229
PNG
(CHEMBL3403327)
Show SMILES NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
Show InChI InChI=1S/C12H11FN2O4S2/c13-9-4-6-11(7-5-9)21(18,19)15-10-2-1-3-12(8-10)20(14,16)17/h1-8,15H,(H2,14,16,17)
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n/an/a 1.27E+3n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50004305
PNG
(CHEMBL3237784)
Show SMILES Clc1ccc(cc1Cl)C1=Nn2c(SC1)nnc2-c1ccncc1 |t:9|
Show InChI InChI=1S/C15H9Cl2N5S/c16-11-2-1-10(7-12(11)17)13-8-23-15-20-19-14(22(15)21-13)9-3-5-18-6-4-9/h1-7H,8H2
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n/an/a 1.32E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-nitrophenyl phosphate as substrate preincubated for 10 mins before substrate addition afte...


Eur J Med Chem 78: 167-77 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.046
BindingDB Entry DOI: 10.7270/Q2F76F32
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50247721
PNG
(4-fluoro-N-(4-sulfamoylbenzyl)benzenesulfonamide |...)
Show SMILES NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C13H13FN2O4S2/c14-11-3-7-13(8-4-11)22(19,20)16-9-10-1-5-12(6-2-10)21(15,17)18/h1-8,16H,9H2,(H2,15,17,18)
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n/an/a 1.35E+3n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star chemiluminescent substrate assessed as change in luminescence by spectrophotometric...


Bioorg Med Chem 23: 2435-44 (2015)


Article DOI: 10.1016/j.bmc.2015.03.054
BindingDB Entry DOI: 10.7270/Q2WW7KC8
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234719
PNG
(CHEMBL4062180)
Show SMILES CCCCCc1cc(=O)c2cc(ccc2n1Cc1ccc(OC)cc1)[N+]([O-])=O
Show InChI InChI=1S/C22H24N2O4/c1-3-4-5-6-17-14-22(25)20-13-18(24(26)27)9-12-21(20)23(17)15-16-7-10-19(28-2)11-8-16/h7-14H,3-6,15H2,1-2H3
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n/an/a 1.38E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50276361
PNG
(CHEMBL4129493)
Show SMILES Cc1ccc(c(C)c1)-n1c(cs\c1=N\NC(=O)c1cc2ccccc2oc1=O)-c1cc2ccccc2oc1=O |(6.52,-45.77,;7.43,-44.52,;8.97,-44.68,;9.87,-43.44,;9.24,-42.03,;7.71,-41.87,;7.93,-40.44,;6.8,-43.11,;10.15,-40.79,;11.69,-40.79,;12.17,-39.33,;10.92,-38.42,;9.68,-39.33,;8.21,-38.85,;7,-39.8,;5.6,-39.41,;4.45,-40.44,;5.28,-37.9,;6.42,-36.87,;6.1,-35.36,;7.24,-34.34,;6.93,-32.83,;5.46,-32.35,;4.32,-33.38,;4.64,-34.88,;3.49,-35.91,;3.8,-37.42,;2.66,-38.46,;12.6,-42.04,;14.13,-41.87,;15.03,-43.13,;16.56,-42.98,;17.45,-44.22,;16.82,-45.63,;15.29,-45.78,;14.39,-44.53,;12.86,-44.69,;11.97,-43.45,;10.46,-43.84,)|
Show InChI InChI=1S/C30H21N3O5S/c1-17-11-12-23(18(2)13-17)33-24(21-14-19-7-3-5-9-25(19)37-28(21)35)16-39-30(33)32-31-27(34)22-15-20-8-4-6-10-26(20)38-29(22)36/h3-16H,1-2H3,(H,31,34)/b32-30+
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n/an/a 1.38E+3n/an/an/an/an/an/a



Abbottabad University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using pNPP as substrate preincubated for 10 mins followed by substrate addition measured after 30 ...


Bioorg Med Chem 26: 3731-3762 (2018)


Article DOI: 10.1016/j.bmc.2018.05.042
BindingDB Entry DOI: 10.7270/Q29889HN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM223075
PNG
((E)-N'-(2'-hydroxybenzylidene)isonicotinoh...)
Show SMILES Oc1ccccc1\C=N\NC(=O)c1ccncc1
Show InChI InChI=1S/C13H11N3O2/c17-12-4-2-1-3-11(12)9-15-16-13(18)10-5-7-14-8-6-10/h1-9,17H,(H,16,18)/b15-9+
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n/an/a 1.44E+3n/an/an/an/a9.837



Quaid-I-Azam University



Assay Description
The assay conditions were optimized with some changes in formerly reported spectrophotometric method. The composition of assay buffer of pH 9.8 was a...


Chem Biol Drug Des 89: 365-370 (2017)


Article DOI: 10.1111/cbdd.12861
BindingDB Entry DOI: 10.7270/Q2F47N10
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM223079
PNG
((E)-N'-(Pyridin-3'-ylmethylene)isonicotino...)
Show SMILES O=C(N\N=C\c1cccnc1)c1ccncc1
Show InChI InChI=1S/C12H10N4O/c17-12(11-3-6-13-7-4-11)16-15-9-10-2-1-5-14-8-10/h1-9H,(H,16,17)/b15-9+
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n/an/a 1.46E+3n/an/an/an/a9.837



Quaid-I-Azam University



Assay Description
The assay conditions were optimized with some changes in formerly reported spectrophotometric method. The composition of assay buffer of pH 9.8 was a...


Chem Biol Drug Des 89: 365-370 (2017)


Article DOI: 10.1111/cbdd.12861
BindingDB Entry DOI: 10.7270/Q2F47N10
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275874
PNG
(CHEMBL4125873)
Show SMILES Fc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Show InChI InChI=1S/C18H14FN5O3S2/c19-13-4-2-12(3-5-13)16(25)23-18(28)22-14-6-8-15(9-7-14)29(26,27)24-17-20-10-1-11-21-17/h1-11H,(H,20,21,24)(H2,22,23,25,28)
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n/an/a 1.55E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275882
PNG
(CHEMBL4126859)
Show SMILES CCCC(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Show InChI InChI=1S/C15H17N5O3S2/c1-2-4-13(21)19-15(24)18-11-5-7-12(8-6-11)25(22,23)20-14-16-9-3-10-17-14/h3,5-10H,2,4H2,1H3,(H,16,17,20)(H2,18,19,21,24)
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n/an/a 1.64E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234716
PNG
(CHEMBL4104441)
Show SMILES Cc1ccc(cc1)-c1[nH]c2ccc(NC(=O)C(F)(F)F)cc2c(=O)c1-c1ccc(C)cc1
Show InChI InChI=1S/C25H19F3N2O2/c1-14-3-7-16(8-4-14)21-22(17-9-5-15(2)6-10-17)30-20-12-11-18(13-19(20)23(21)31)29-24(32)25(26,27)28/h3-13H,1-2H3,(H,29,32)(H,30,31)
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n/an/a 1.67E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50275883
PNG
(CHEMBL4126997)
Show SMILES CCCCCCCC(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Show InChI InChI=1S/C19H25N5O3S2/c1-2-3-4-5-6-8-17(25)23-19(28)22-15-9-11-16(12-10-15)29(26,27)24-18-20-13-7-14-21-18/h7,9-14H,2-6,8H2,1H3,(H,20,21,24)(H2,22,23,25,28)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-NPP as substrate pretreated for 10 mins followed by substrate addition measured after 30 m...


Bioorg Med Chem 26: 3707-3715 (2018)


Article DOI: 10.1016/j.bmc.2018.06.002
BindingDB Entry DOI: 10.7270/Q2C53PBN
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222261
PNG
((Z)-4-(2-((E)-4-(4-methoxyphenyl)-1-morpholino-2-o...)
Show SMILES COc1ccc(\C=C\C(=O)C(=N\Nc2ccc(cc2)S(N)(=O)=O)\N2CCOCC2)cc1
Show InChI InChI=1S/C21H24N4O5S/c1-29-18-7-2-16(3-8-18)4-11-20(26)21(25-12-14-30-15-13-25)24-23-17-5-9-19(10-6-17)31(22,27)28/h2-11,23H,12-15H2,1H3,(H2,22,27,28)/b11-4+,24-21-
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n/an/a 1.71E+3n/an/an/an/a9.837



COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM223074
PNG
((E)-N'-(4'-Methoxybenzylidene)isonicotinoh...)
Show SMILES COc1ccc(\C=N\NC(=O)c2ccncc2)cc1
Show InChI InChI=1S/C14H13N3O2/c1-19-13-4-2-11(3-5-13)10-16-17-14(18)12-6-8-15-9-7-12/h2-10H,1H3,(H,17,18)/b16-10+
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n/an/a 1.74E+3n/an/an/an/a9.837



Quaid-I-Azam University



Assay Description
The assay conditions were optimized with some changes in formerly reported spectrophotometric method. The composition of assay buffer of pH 9.8 was a...


Chem Biol Drug Des 89: 365-370 (2017)


Article DOI: 10.1111/cbdd.12861
BindingDB Entry DOI: 10.7270/Q2F47N10
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM223077
PNG
((E)-N'-(4'-Hydroxy-3-methoxybenzylidene)is...)
Show SMILES COc1cc(\C=N\NC(=O)c2ccncc2)ccc1O
Show InChI InChI=1S/C14H13N3O3/c1-20-13-8-10(2-3-12(13)18)9-16-17-14(19)11-4-6-15-7-5-11/h2-9,18H,1H3,(H,17,19)/b16-9+
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n/an/a 1.92E+3n/an/an/an/a9.837



Quaid-I-Azam University



Assay Description
The assay conditions were optimized with some changes in formerly reported spectrophotometric method. The composition of assay buffer of pH 9.8 was a...


Chem Biol Drug Des 89: 365-370 (2017)


Article DOI: 10.1111/cbdd.12861
BindingDB Entry DOI: 10.7270/Q2F47N10
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50004311
PNG
(CHEMBL3237532)
Show SMILES Fc1ccc(cc1Cl)-c1nn2c(nnc2s1)-c1ccncc1
Show InChI InChI=1S/C14H7ClFN5S/c15-10-7-9(1-2-11(10)16)13-20-21-12(18-19-14(21)22-13)8-3-5-17-6-4-8/h1-7H
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n/an/a 2.01E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-nitrophenyl phosphate as substrate preincubated for 10 mins before substrate addition afte...


Eur J Med Chem 78: 167-77 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.046
BindingDB Entry DOI: 10.7270/Q2F76F32
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234717
PNG
(CHEMBL4076852)
Show SMILES COc1ccc(Cn2c(-c3ccc(C)cc3)c(-c3ccc(OC)cc3)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1
Show InChI InChI=1S/C31H26N2O5/c1-20-4-8-23(9-5-20)30-29(22-10-15-26(38-3)16-11-22)31(34)27-18-24(33(35)36)12-17-28(27)32(30)19-21-6-13-25(37-2)14-7-21/h4-18H,19H2,1-3H3
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n/an/a 2.04E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50165146
PNG
(CHEMBL3798795)
Show SMILES CCCCOC1Oc2ccccc2C(=O)\C1=C/Nc1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C20H22N2O5S/c1-2-3-11-26-20-17(19(23)16-9-4-5-10-18(16)27-20)13-22-14-7-6-8-15(12-14)28(21,24)25/h4-10,12-13,20,22H,2-3,11H2,1H3,(H2,21,24,25)/b17-13+
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n/an/a 2.29E+3n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase preincubated for 3 to 5 mins followed by CDP-star substrate addition measured after 15 mins by lum...


Eur J Med Chem 115: 484-94 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.073
BindingDB Entry DOI: 10.7270/Q2K939D7
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50165150
PNG
(CHEMBL3799027)
Show SMILES COC1Oc2ccc(Cl)cc2C(=O)\C1=C/Nc1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C18H25NO2/c1-11-5-6-13(9-12(11)2)15-10-14-7-8-16(19(14)3)17(15)18(20)21-4/h5-6,9,14-17H,7-8,10H2,1-4H3
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n/an/a 2.32E+3n/an/an/an/an/an/a



Forman Christian College (A Chartered University)

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase preincubated for 3 to 5 mins followed by CDP-star substrate addition measured after 15 mins by lum...


Eur J Med Chem 115: 484-94 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.073
BindingDB Entry DOI: 10.7270/Q2K939D7
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50004328
PNG
(CHEBI:63036 | POTASSIUM PHOSPHATE, MONOBASIC)
Show SMILES [K+].OP(O)([O-])=O
Show InChI InChI=1S/K.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+1;/p-1
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n/an/a 2.41E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-nitrophenyl phosphate as substrate preincubated for 10 mins before substrate addition afte...


Eur J Med Chem 78: 167-77 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.046
BindingDB Entry DOI: 10.7270/Q2F76F32
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234701
PNG
(CHEMBL4094414)
Show SMILES COc1ccc(Cn2c(-c3ccc(C)cc3)c(Br)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1
Show InChI InChI=1S/C24H19BrN2O4/c1-15-3-7-17(8-4-15)23-22(25)24(28)20-13-18(27(29)30)9-12-21(20)26(23)14-16-5-10-19(31-2)11-6-16/h3-13H,14H2,1-2H3
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n/an/a 2.43E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM223078
PNG
((E)-N'-(Pyridin-4'-ylmethylene)isonicotino...)
Show SMILES O=C(N\N=C\c1ccncc1)c1ccncc1
Show InChI InChI=1S/C12H10N4O/c17-12(11-3-7-14-8-4-11)16-15-9-10-1-5-13-6-2-10/h1-9H,(H,16,17)/b15-9+
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n/an/a 2.46E+3n/an/an/an/a9.837



Quaid-I-Azam University



Assay Description
The assay conditions were optimized with some changes in formerly reported spectrophotometric method. The composition of assay buffer of pH 9.8 was a...


Chem Biol Drug Des 89: 365-370 (2017)


Article DOI: 10.1111/cbdd.12861
BindingDB Entry DOI: 10.7270/Q2F47N10
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234702
PNG
(CHEMBL4066927)
Show SMILES CC(c1ccccc1)n1c(-c2ccc(C)cc2)c(Br)c(=O)c2cc(ccc12)[N+]([O-])=O
Show InChI InChI=1S/C24H19BrN2O3/c1-15-8-10-18(11-9-15)23-22(25)24(28)20-14-19(27(29)30)12-13-21(20)26(23)16(2)17-6-4-3-5-7-17/h3-14,16H,1-2H3
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n/an/a 2.47E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM222263
PNG
((Z)-4-(2-((E)-1-morpholino-2-oxo-4-(3,4,5-Trimetho...)
Show SMILES COc1cc(\C=C\C(=O)C(=N\Nc2ccc(cc2)S(N)(=O)=O)\N2CCOCC2)cc(OC)c1OC
Show InChI InChI=1S/C23H28N4O7S/c1-31-20-14-16(15-21(32-2)22(20)33-3)4-9-19(28)23(27-10-12-34-13-11-27)26-25-17-5-7-18(8-6-17)35(24,29)30/h4-9,14-15,25H,10-13H2,1-3H3,(H2,24,29,30)/b9-4+,26-23-
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n/an/a 2.57E+3n/an/an/an/a9.837



COMSATS Institute of Information Technology



Assay Description
Alkaline phosphatase assay was optimized and performed in the same way as previously reported method with slight modifications [Sergienko et al., Nat...


Bioorg Chem 70: 229-236 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.003
BindingDB Entry DOI: 10.7270/Q2K07334
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50004322
PNG
(CHEMBL3237542)
Show SMILES Fc1ccc(OCc2nn3c(nnc3s2)-c2ccncc2)cc1
Show InChI InChI=1S/C15H10FN5OS/c16-11-1-3-12(4-2-11)22-9-13-20-21-14(18-19-15(21)23-13)10-5-7-17-8-6-10/h1-8H,9H2
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n/an/a 2.59E+3n/an/an/an/an/an/a



Quaid-i-Azam University

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using p-nitrophenyl phosphate as substrate preincubated for 10 mins before substrate addition afte...


Eur J Med Chem 78: 167-77 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.046
BindingDB Entry DOI: 10.7270/Q2F76F32
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Bos taurus (Cattle))
BDBM50234718
PNG
(CHEMBL4097906)
Show SMILES COc1ccc(Cn2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1
Show InChI InChI=1S/C31H26N2O4/c1-20-4-10-23(11-5-20)29-30(24-12-6-21(2)7-13-24)32(19-22-8-15-26(37-3)16-9-22)28-17-14-25(33(35)36)18-27(28)31(29)34/h4-18H,19H2,1-3H3
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n/an/a 2.92E+3n/an/an/an/an/an/a



Universit£t Rostock

Curated by ChEMBL


Assay Description
Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...


Eur J Med Chem 126: 408-420 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.036
BindingDB Entry DOI: 10.7270/Q2DZ0BKR
More data for this
Ligand-Target Pair
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