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Found 6474 hits Enz. Inhib. hit(s) with Target = 'Casein Kinase I'   
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
Casein Kinase I


(Rattus norvegicus (rat))
BDBM7533
PNG
((2R)-2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]am...)
Show SMILES CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1
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n/an/a 1.00E+5n/an/an/an/a7.230



Chinese Academy of Sciences



Assay Description
Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/[gamma-32P] ATP. 32P...


J Biol Chem 280: 31220-9 (2005)


Article DOI: 10.1074/jbc.M500805200
BindingDB Entry DOI: 10.7270/Q2Q81B9F
More data for this
Ligand-Target Pair
Casein Kinase I


(Rattus norvegicus (rat))
BDBM10909
PNG
((2R)-2-({6-[benzyl(methyl)amino]-9-(propan-2-yl)-9...)
Show SMILES CC[C@H](CO)Nc1nc(N(C)Cc2ccccc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C20H28N6O/c1-5-16(12-27)22-20-23-18(25(4)11-15-9-7-6-8-10-15)17-19(24-20)26(13-21-17)14(2)3/h6-10,13-14,16,27H,5,11-12H2,1-4H3,(H,22,23,24)/t16-/m1/s1
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n/an/a>1.00E+6n/an/an/an/a7.230



Chinese Academy of Sciences



Assay Description
Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/[gamma-32P] ATP. 32P...


J Biol Chem 280: 31220-9 (2005)


Article DOI: 10.1074/jbc.M500805200
BindingDB Entry DOI: 10.7270/Q2Q81B9F
More data for this
Ligand-Target Pair
Casein Kinase I


(Rattus norvegicus (rat))
BDBM10910
PNG
((2R)-2-{[6-(benzyloxy)-9-(propan-2-yl)-9H-purin-2-...)
Show SMILES CC[C@H](CO)Nc1nc(OCc2ccccc2)c2ncn(C(C)C)c2n1
Show InChI InChI=1S/C19H25N5O2/c1-4-15(10-25)21-19-22-17-16(20-12-24(17)13(2)3)18(23-19)26-11-14-8-6-5-7-9-14/h5-9,12-13,15,25H,4,10-11H2,1-3H3,(H,21,22,23)/t15-/m1/s1
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n/an/a>1.00E+6n/an/an/an/a7.230



Chinese Academy of Sciences



Assay Description
Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/[gamma-32P] ATP. 32P...


J Biol Chem 280: 31220-9 (2005)


Article DOI: 10.1074/jbc.M500805200
BindingDB Entry DOI: 10.7270/Q2Q81B9F
More data for this
Ligand-Target Pair
Casein kinase I isoform alpha (CK1 Alpha)


(Homo sapiens (human))
BDBM50011236
PNG
(CHEMBL344314 | Isoquinoline-5-sulfonic acid (2-ami...)
Show SMILES NCCNS(=O)(=O)c1cccc2cnccc12
Show InChI InChI=1S/C11H13N3O2S/c12-5-7-14-17(15,16)11-3-1-2-9-8-13-6-4-10(9)11/h1-4,6,8,14H,5,7,12H2
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n/an/a 1.10E+5n/an/an/an/a7.430



Nagoya University School of Medicine



Assay Description
Casein kinase activities were determined under the conditions as described by Huang et al (1982).


J Biol Chem 264: 4924-7 (1989)


BindingDB Entry DOI: 10.7270/Q2K072VK
More data for this
Ligand-Target Pair
Casein kinase I isoform alpha (CK1 Alpha)


(Homo sapiens (human))
BDBM92673
PNG
(Isoquinolinesulfonamide, CKI-6)
Show SMILES NCCNS(=O)(=O)c1cccc2ccncc12
Show InChI InChI=1S/C11H13N3O2S/c12-5-7-14-17(15,16)11-3-1-2-9-4-6-13-8-10(9)11/h1-4,6,8,14H,5,7,12H2
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n/an/a 5.00E+4n/an/an/an/a7.430



Nagoya University School of Medicine



Assay Description
Casein kinase activities were determined under the conditions as described by Huang et al (1982).


J Biol Chem 264: 4924-7 (1989)


BindingDB Entry DOI: 10.7270/Q2K072VK
More data for this
Ligand-Target Pair
Casein kinase I isoform alpha (CK1 Alpha)


(Homo sapiens (human))
BDBM92674
PNG
(Isoquinolinesulfonamide, CKI-7)
Show SMILES NCCNS(=O)(=O)c1ccc(Cl)c2ccncc12
Show InChI InChI=1S/C11H12ClN3O2S/c12-10-1-2-11(18(16,17)15-6-4-13)9-7-14-5-3-8(9)10/h1-3,5,7,15H,4,6,13H2
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n/an/a 9.50E+3n/an/an/an/a7.430



Nagoya University School of Medicine



Assay Description
Casein kinase activities were determined under the conditions as described by Huang et al (1982).


J Biol Chem 264: 4924-7 (1989)


BindingDB Entry DOI: 10.7270/Q2K072VK
More data for this
Ligand-Target Pair
Casein Kinase II


(Homo sapiens (human))
BDBM92673
PNG
(Isoquinolinesulfonamide, CKI-6)
Show SMILES NCCNS(=O)(=O)c1cccc2ccncc12
Show InChI InChI=1S/C11H13N3O2S/c12-5-7-14-17(15,16)11-3-1-2-9-4-6-13-8-10(9)11/h1-4,6,8,14H,5,7,12H2
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n/an/a>3.00E+5n/an/an/an/a7.430



Nagoya University School of Medicine



Assay Description
Casein kinase activities were determined under the conditions as described by Huang et al (1982).


J Biol Chem 264: 4924-7 (1989)


BindingDB Entry DOI: 10.7270/Q2K072VK
More data for this
Ligand-Target Pair
Casein Kinase II


(Homo sapiens (human))
BDBM50011236
PNG
(CHEMBL344314 | Isoquinoline-5-sulfonic acid (2-ami...)
Show SMILES NCCNS(=O)(=O)c1cccc2cnccc12
Show InChI InChI=1S/C11H13N3O2S/c12-5-7-14-17(15,16)11-3-1-2-9-8-13-6-4-10(9)11/h1-4,6,8,14H,5,7,12H2
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n/an/a>3.00E+5n/an/an/an/a7.430



Nagoya University School of Medicine



Assay Description
Casein kinase activities were determined under the conditions as described by Huang et al (1982).


J Biol Chem 264: 4924-7 (1989)


BindingDB Entry DOI: 10.7270/Q2K072VK
More data for this
Ligand-Target Pair
Casein Kinase II


(Homo sapiens (human))
BDBM92674
PNG
(Isoquinolinesulfonamide, CKI-7)
Show SMILES NCCNS(=O)(=O)c1ccc(Cl)c2ccncc12
Show InChI InChI=1S/C11H12ClN3O2S/c12-10-1-2-11(18(16,17)15-6-4-13)9-7-14-5-3-8(9)10/h1-3,5,7,15H,4,6,13H2
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n/an/a 9.00E+4n/an/an/an/a7.430



Nagoya University School of Medicine



Assay Description
Casein kinase activities were determined under the conditions as described by Huang et al (1982).


J Biol Chem 264: 4924-7 (1989)


BindingDB Entry DOI: 10.7270/Q2K072VK
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34046
PNG
(iodinated benzimidazole, 9a)
Show SMILES CCc1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C9H6I4N2/c1-2-3-14-8-6(12)4(10)5(11)7(13)9(8)15-3/h2H2,1H3,(H,14,15)
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19 -45.8n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34038
PNG
(4,5,6,7-tetraiodobenzimidazole (TIBI), 1a)
Show SMILES Ic1c(I)c(I)c2[nH]cnc2c1I
Show InChI InChI=1S/C7H2I4N2/c8-2-3(9)5(11)7-6(4(2)10)12-1-13-7/h1H,(H,12,13)
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23 -45.4n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34044
PNG
(iodinated benzimidazole, 7a)
Show SMILES Cc1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C8H4I4N2/c1-2-13-7-5(11)3(9)4(10)6(12)8(7)14-2/h1H3,(H,13,14)
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24 -45.2n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34051
PNG
(iodinated benzimidazole, 14)
Show SMILES OCCNc1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C9H7I4N3O/c10-3-4(11)6(13)8-7(5(3)12)15-9(16-8)14-1-2-17/h17H,1-2H2,(H2,14,15,16)
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27 -44.9n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34054
PNG
(iodinated benzimidazole, 17)
Show SMILES Ic1c(I)c(I)c2[nH]c(=O)[nH]c2c1I
Show InChI InChI=1S/C7H2I4N2O/c8-1-2(9)4(11)6-5(3(1)10)12-7(14)13-6/h(H2,12,13,14)
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50 -43.3n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34052
PNG
(iodinated benzimidazole, 15)
Show SMILES Ic1c(I)c(I)c2[nH]c(=S)[nH]c2c1I
Show InChI InChI=1S/C7H2I4N2S/c8-1-2(9)4(11)6-5(3(1)10)12-7(14)13-6/h(H2,12,13,14)
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50 -43.3n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34053
PNG
(iodinated benzimidazole, 16)
Show SMILES OC(=O)CSc1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C9H4I4N2O2S/c10-3-4(11)6(13)8-7(5(3)12)14-9(15-8)18-1-2(16)17/h1H2,(H,14,15)(H,16,17)
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54 -43.2n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34048
PNG
(iodinated benzimidazole, 11a)
Show SMILES FC(F)(F)C(F)(F)c1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C9HF5I4N2/c10-8(11,9(12,13)14)7-19-5-3(17)1(15)2(16)4(18)6(5)20-7/h(H,19,20)
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70 -42.5n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34043
PNG
(iodinated benzimidazole, 6a)
Show SMILES Brc1c(I)c(Br)c2nc[nH]c2c1I
Show InChI InChI=1S/C7H2Br2I2N2/c8-2-4(10)3(9)6-7(5(2)11)13-1-12-6/h1H,(H,12,13)
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75 -42.3n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34050
PNG
(iodinated benzimidazole, 13a)
Show SMILES Brc1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C7HBrI4N2/c8-7-13-5-3(11)1(9)2(10)4(12)6(5)14-7/h(H,13,14)
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90 -41.8n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34040
PNG
(iodinated benzimidazole, 3a)
Show SMILES Brc1c(I)c(I)c2[nH]cnc2c1I
Show InChI InChI=1S/C7H2BrI3N2/c8-2-3(9)5(11)7-6(4(2)10)12-1-13-7/h1H,(H,12,13)
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100 -41.6n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34049
PNG
(iodinated benzimidazole, 12a)
Show SMILES Clc1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C7HClI4N2/c8-7-13-5-3(11)1(9)2(10)4(12)6(5)14-7/h(H,13,14)
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120 -41.1n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34047
PNG
(iodinated benzimidazole, 10a)
Show SMILES FC(F)(F)c1nc2c(I)c(I)c(I)c(I)c2[nH]1
Show InChI InChI=1S/C8HF3I4N2/c9-8(10,11)7-16-5-3(14)1(12)2(13)4(15)6(5)17-7/h(H,16,17)
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120 -41.1n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34056
PNG
(iodinated benzimidazole, 23)
Show SMILES NC(=O)Cn1cnc2c(I)c(I)c(I)c(I)c12
Show InChI InChI=1S/C9H5I4N3O/c10-4-5(11)7(13)9-8(6(4)12)15-2-16(9)1-3(14)17/h2H,1H2,(H2,14,17)
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130 -40.9n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34055
PNG
(iodinated benzimidazole, 21)
Show SMILES OC(=O)Cn1cnc2c(I)c(I)c(I)c(I)c12
Show InChI InChI=1S/C9H4I4N2O2/c10-4-5(11)7(13)9-8(6(4)12)14-2-15(9)1-3(16)17/h2H,1H2,(H,16,17)
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140 -40.7n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34058
PNG
(iodinated benzimidazole, 27)
Show SMILES NNC(=O)Cn1cnc2c(I)c(I)c(I)c(I)c12
Show InChI InChI=1S/C9H6I4N4O/c10-4-5(11)7(13)9-8(6(4)12)15-2-17(9)1-3(18)16-14/h2H,1,14H2,(H,16,18)
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160 -40.3n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34039
PNG
(iodinated benzimidazole, 2a)
Show SMILES Clc1c(I)c(I)c2nc[nH]c2c1I
Show InChI InChI=1S/C7H2ClI3N2/c8-2-3(9)5(11)7-6(4(2)10)12-1-13-7/h1H,(H,12,13)
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160 -40.3n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Homo sapiens (human))
BDBM11319
PNG
((5-oxo-5,6-dihydroindolo[1,2-a]quinazolin-7-yl)ace...)
Show SMILES OC(=O)Cc1c2ccccc2n2c1[nH]c(=O)c1ccccc21
Show InChI InChI=1S/C17H12N2O3/c20-15(21)9-12-10-5-1-3-7-13(10)19-14-8-4-2-6-11(14)17(22)18-16(12)19/h1-8H,9H2,(H,18,22)(H,20,21)
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170 -38.2 390n/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


Biochem J 374: 639-46 (2003)


Article DOI: 10.1042/BJ20030674
BindingDB Entry DOI: 10.7270/Q2BV7DTQ
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34057
PNG
(iodinated benzimidazole, 25)
Show SMILES CNC(=O)Cn1cnc2c(I)c(I)c(I)c(I)c12
Show InChI InChI=1S/C10H7I4N3O/c1-15-4(18)2-17-3-16-9-7(13)5(11)6(12)8(14)10(9)17/h3H,2H2,1H3,(H,15,18)
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180 -40.0n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34045
PNG
(iodinated benzimidazole, 8a)
Show SMILES Cc1nc2c(I)c(Cl)c(Cl)c(I)c2[nH]1
Show InChI InChI=1S/C8H4Cl2I2N2/c1-2-13-7-5(11)3(9)4(10)6(12)8(7)14-2/h1H3,(H,13,14)
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330 -38.5n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Zea mays (Maize))
BDBM11315
PNG
(1,4-diamino-5,8-dihydroxy-9,10-dihydroanthracene-9...)
Show SMILES Nc1ccc(N)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
Show InChI InChI=1S/C14H10N2O4/c15-5-1-2-6(16)10-9(5)13(19)11-7(17)3-4-8(18)12(11)14(10)20/h1-4,17-18H,15-16H2
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350 -36.5n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


J Biol Chem 278: 1831-6 (2003)


Article DOI: 10.1074/jbc.M209367200
BindingDB Entry DOI: 10.7270/Q2GH9G5K
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein Kinase II


(Homo sapiens (human))
BDBM11323
PNG
(4,5,6,7-tetrabromo-1H-1,2,3-benzotriazole | 4,5,6,...)
Show SMILES Brc1c(Br)c(Br)c2[nH]nnc2c1Br
Show InChI InChI=1S/C6HBr4N3/c7-1-2(8)4(10)6-5(3(1)9)11-13-12-6/h(H,11,12,13)
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400 -36.2 500n/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


Biochem J 374: 639-46 (2003)


Article DOI: 10.1042/BJ20030674
BindingDB Entry DOI: 10.7270/Q2BV7DTQ
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34041
PNG
(iodinated benzimidazole, 4a)
Show SMILES Clc1c(Cl)c(I)c2[nH]cnc2c1I
Show InChI InChI=1S/C7H2Cl2I2N2/c8-2-3(9)5(11)7-6(4(2)10)12-1-13-7/h1H,(H,12,13)
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460 -37.6n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34042
PNG
(iodinated benzimidazole, 5a)
Show SMILES Clc1c(I)c(Cl)c2nc[nH]c2c1I
Show InChI InChI=1S/C7H2Cl2I2N2/c8-2-4(10)3(9)6-7(5(2)11)13-1-12-6/h1H,(H,12,13)
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590 -37.0n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Homo sapiens (human))
BDBM7458
PNG
(5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one...)
Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1
Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
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740 -34.6n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


Biochem J 374: 639-46 (2003)


Article DOI: 10.1042/BJ20030674
BindingDB Entry DOI: 10.7270/Q2BV7DTQ
More data for this
Ligand-Target Pair
Casein Kinase II


(Zea mays (Maize))
BDBM11313
PNG
(1,8-dihydroxy-4-nitro-anthraquinone | 4,5-dihydrox...)
Show SMILES Oc1cccc2C(=O)c3c(ccc(O)c3C(=O)c12)[N+]([O-])=O
Show InChI InChI=1S/C14H7NO6/c16-8-3-1-2-6-10(8)14(19)12-9(17)5-4-7(15(20)21)11(12)13(6)18/h1-5,16-17H
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780 -34.5n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


J Biol Chem 278: 1831-6 (2003)


Article DOI: 10.1074/jbc.M209367200
BindingDB Entry DOI: 10.7270/Q2GH9G5K
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein Kinase II


(Zea mays (Maize))
BDBM11314
PNG
(1,8-dihydroxy-4-nitro-9H-xanthen-9-one | 1,8-dihyd...)
Show SMILES Oc1cccc2oc3c(ccc(O)c3c(=O)c12)[N+]([O-])=O
Show InChI InChI=1S/C13H7NO6/c15-7-2-1-3-9-10(7)12(17)11-8(16)5-4-6(14(18)19)13(11)20-9/h1-5,15-16H
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800 -34.4n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


J Biol Chem 278: 1831-6 (2003)


Article DOI: 10.1074/jbc.M209367200
BindingDB Entry DOI: 10.7270/Q2GH9G5K
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein Kinase II


(Homo sapiens (human))
BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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1.18E+3 -33.5n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


Biochem J 374: 639-46 (2003)


Article DOI: 10.1042/BJ20030674
BindingDB Entry DOI: 10.7270/Q2BV7DTQ
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34059
PNG
(brominated benzimidazole, 20)
Show SMILES OC(=O)Cn1cnc2c(Br)c(Br)c(Br)c(Br)c12
Show InChI InChI=1S/C9H4Br4N2O2/c10-4-5(11)7(13)9-8(6(4)12)14-2-15(9)1-3(16)17/h2H,1H2,(H,16,17)
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1.34E+3 -34.9n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34060
PNG
(brominated benzimidazole, 22)
Show SMILES NC(=O)Cn1cnc2c(Br)c(Br)c(Br)c(Br)c12
Show InChI InChI=1S/C9H5Br4N3O/c10-4-5(11)7(13)9-8(6(4)12)15-2-16(9)1-3(14)17/h2H,1H2,(H2,14,17)
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1.45E+3 -34.7n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34062
PNG
(brominated benzimidazole, 26)
Show SMILES NNC(=O)Cn1cnc2c(Br)c(Br)c(Br)c(Br)c12
Show InChI InChI=1S/C9H6Br4N4O/c10-4-5(11)7(13)9-8(6(4)12)15-2-17(9)1-3(18)16-14/h2H,1,14H2,(H,16,18)
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1.51E+3 -34.6n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Zea mays (Maize))
BDBM11318
PNG
(1,3,8-trihydroxy-6-methyl-9,10-dihydroanthracene-9...)
Show SMILES Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1
Show InChI InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
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1.85E+3 -32.4n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


J Biol Chem 278: 1831-6 (2003)


Article DOI: 10.1074/jbc.M209367200
BindingDB Entry DOI: 10.7270/Q2GH9G5K
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Casein Kinase II


(Homo sapiens (human))
BDBM11318
PNG
(1,3,8-trihydroxy-6-methyl-9,10-dihydroanthracene-9...)
Show SMILES Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1
Show InChI InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
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1.85E+3 -32.4 890n/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


Biochem J 374: 639-46 (2003)


Article DOI: 10.1042/BJ20030674
BindingDB Entry DOI: 10.7270/Q2BV7DTQ
More data for this
Ligand-Target Pair
Casein Kinase II


(Rattus norvegicus (Rat))
BDBM34061
PNG
(brominated benzimidazole, 24)
Show SMILES CNC(=O)Cn1cnc2c(Br)c(Br)c(Br)c(Br)c12
Show InChI InChI=1S/C10H7Br4N3O/c1-15-4(18)2-17-3-16-9-7(13)5(11)6(12)8(14)10(9)17/h3H,2H2,1H3,(H,15,18)
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1.91E+3 -34.0n/an/an/an/an/a7.537



University of Padova



Assay Description
Inhibitory effect of test compound was assessed in reaction buffer containing purified CK2, synthetic peptide substrate, and [gamma-33P]ATP. Assays w...


Bioorg Med Chem 17: 7281-9 (2009)


Article DOI: 10.1016/j.bmc.2009.08.047
BindingDB Entry DOI: 10.7270/Q2NZ860P
More data for this
Ligand-Target Pair
Casein Kinase II


(Homo sapiens (human))
BDBM11324
PNG
((2R,3R,4S,5R)-2-(5,6-dichloro-1H-1,3-benzodiazol-1...)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2cc(Cl)c(Cl)cc12
Show InChI InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2/t9-,10-,11-,12-/m1/s1
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4.50E+3 -30.2n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


Biochem J 374: 639-46 (2003)


Article DOI: 10.1042/BJ20030674
BindingDB Entry DOI: 10.7270/Q2BV7DTQ
More data for this
Ligand-Target Pair
Casein Kinase II


(Zea mays (Maize))
BDBM11317
PNG
(1,8-dihydroxy-9H-xanthen-9-one | Xanthenone-relate...)
Show SMILES Oc1cccc2oc3cccc(O)c3c(=O)c12
Show InChI InChI=1S/C13H8O4/c14-7-3-1-5-9-11(7)13(16)12-8(15)4-2-6-10(12)17-9/h1-6,14-15H
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PubMed
>4.00E+4>-24.8n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


J Biol Chem 278: 1831-6 (2003)


Article DOI: 10.1074/jbc.M209367200
BindingDB Entry DOI: 10.7270/Q2GH9G5K
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Casein Kinase II


(Zea mays (Maize))
BDBM11316
PNG
(1,8-dihydroxy-9,10-dihydroanthracene-9,10-dione | ...)
Show SMILES Oc1cccc2C(=O)c3cccc(O)c3C(=O)c12
Show InChI InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H
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Article
PubMed
>4.00E+4>-24.8n/an/an/an/an/a7.522



University of Padova



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...


J Biol Chem 278: 1831-6 (2003)


Article DOI: 10.1074/jbc.M209367200
BindingDB Entry DOI: 10.7270/Q2GH9G5K
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Casein kinase II alpha/beta


(Homo sapiens (human)-Rattus norvegicus)
BDBM248085
PNG
(3-{[2-chloro-4-(4-methyl-1,1-dioxido-3-oxoisothiaz...)
Show SMILES CC1CS(=O)(=O)N(C1=O)c1ccc(C(=O)Nc2cccc(c2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C18H15ClN2O6S/c1-10-9-28(26,27)21(17(10)23)13-5-6-14(15(19)8-13)16(22)20-12-4-2-3-11(7-12)18(24)25/h2-8,10H,9H2,1H3,(H,20,22)(H,24,25)
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n/an/a 3.60E+3n/an/an/an/a7.530



NAS of Ukraine



Assay Description
Each test was performed twice in a total reaction volume of 30 μL, containing 6 μg of peptide substrate RRRDDDSDDD (New England Biolabs (UK) Lt...


J Enzyme Inhib Med Chem 29: 338-43 (2014)


Article DOI: 10.3109/14756366.2013.782024
BindingDB Entry DOI: 10.7270/Q2DB80RP
More data for this
Ligand-Target Pair
Casein kinase II alpha/beta


(Homo sapiens (human)-Rattus norvegicus)
BDBM248086
PNG
(5-{[2-chloro-4-(4-methyl-1,1-dioxido-3-oxoisothiaz...)
Show SMILES CC1CS(=O)(=O)N(C1=O)c1ccc(C(=O)Nc2ccc(O)c(c2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C18H15ClN2O7S/c1-9-8-29(27,28)21(17(9)24)11-3-4-12(14(19)7-11)16(23)20-10-2-5-15(22)13(6-10)18(25)26/h2-7,9,22H,8H2,1H3,(H,20,23)(H,25,26)
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n/an/a 6.00E+3n/an/an/an/a7.530



NAS of Ukraine



Assay Description
Each test was performed twice in a total reaction volume of 30 μL, containing 6 μg of peptide substrate RRRDDDSDDD (New England Biolabs (UK) Lt...


J Enzyme Inhib Med Chem 29: 338-43 (2014)


Article DOI: 10.3109/14756366.2013.782024
BindingDB Entry DOI: 10.7270/Q2DB80RP
More data for this
Ligand-Target Pair
Casein kinase II alpha/beta


(Homo sapiens (human)-Rattus norvegicus)
BDBM248087
PNG
(3-{[2-chloro-4-(4-methyl-1,1-dioxido-3-oxoisothiaz...)
Show SMILES CC1CS(=O)(=O)N(C1=O)c1ccc(C(=O)Nc2cc(ccc2O)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C18H15ClN2O7S/c1-9-8-29(27,28)21(17(9)24)11-3-4-12(13(19)7-11)16(23)20-14-6-10(18(25)26)2-5-15(14)22/h2-7,9,22H,8H2,1H3,(H,20,23)(H,25,26)
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n/an/a 3.70E+3n/an/an/an/a7.530



NAS of Ukraine



Assay Description
Each test was performed twice in a total reaction volume of 30 μL, containing 6 μg of peptide substrate RRRDDDSDDD (New England Biolabs (UK) Lt...


J Enzyme Inhib Med Chem 29: 338-43 (2014)


Article DOI: 10.3109/14756366.2013.782024
BindingDB Entry DOI: 10.7270/Q2DB80RP
More data for this
Ligand-Target Pair
Casein kinase II alpha/beta


(Homo sapiens (human)-Rattus norvegicus)
BDBM248088
PNG
(4-{[2-chloro-4-(4-methyl-1,1-dioxido-3-oxoisothiaz...)
Show SMILES CC1CS(=O)(=O)N(C1=O)c1ccc(C(=O)Nc2ccc(C(O)=O)c(O)c2)c(Cl)c1
Show InChI InChI=1S/C18H15ClN2O7S/c1-9-8-29(27,28)21(17(9)24)11-3-5-12(14(19)7-11)16(23)20-10-2-4-13(18(25)26)15(22)6-10/h2-7,9,22H,8H2,1H3,(H,20,23)(H,25,26)
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UniChem
Article
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n/an/a 3.50E+3n/an/an/an/a7.530



NAS of Ukraine



Assay Description
Each test was performed twice in a total reaction volume of 30 μL, containing 6 μg of peptide substrate RRRDDDSDDD (New England Biolabs (UK) Lt...


J Enzyme Inhib Med Chem 29: 338-43 (2014)


Article DOI: 10.3109/14756366.2013.782024
BindingDB Entry DOI: 10.7270/Q2DB80RP
More data for this
Ligand-Target Pair
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