Compile Data Set for Download or QSAR
Found 86 Enz. Inhib. hit(s) with all data for entry = 50040888
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401549(CHEMBL2207081)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(9-22-6-5-19-21-22)15(7-11)20-25(23,24)12-3-4-13(17)14(18)8-12/h1-8,20H,9H2
Affinity DataKi:  10nMAssay Description:Binding affinity to human CCR2More data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401547(CHEMBL2207098)
Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C15H10Cl4N4O2S/c16-11-2-1-10(6-13(11)18)26(24,25)21-15-7-14(19)12(17)5-9(15)8-23-4-3-20-22-23/h1-7,21H,8H2
Affinity DataKi:  10nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401550(CHEMBL2207084)
Show SMILES Cc1nnnn1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl3N5O2S/c1-9-19-21-22-23(9)8-10-2-3-11(16)6-15(10)20-26(24,25)12-4-5-13(17)14(18)7-12/h2-7,20H,8H2,1H3
Affinity DataKi:  10nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401561(CHEMBL2207082)
Show SMILES Clc1ccc(Cn2cnnc2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(7-22-8-19-20-9-22)15(5-11)21-25(23,24)12-3-4-13(17)14(18)6-12/h1-6,8-9,21H,7H2
Affinity DataKi:  10nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401549(CHEMBL2207081)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(9-22-6-5-19-21-22)15(7-11)20-25(23,24)12-3-4-13(17)14(18)8-12/h1-8,20H,9H2
Affinity DataKi:  10nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401555(CHEMBL2207101)
Show SMILES FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C16H11Cl2F3N4O2S/c17-13-6-10(9-25-5-4-22-24-25)15(8-14(13)18)23-28(26,27)12-3-1-2-11(7-12)16(19,20)21/h1-8,23H,9H2
Affinity DataKi:  12.6nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401546(CHEMBL2207100)
Show SMILES Clc1ccc(s1)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C13H9Cl3N4O2S2/c14-9-5-8(7-20-4-3-17-19-20)11(6-10(9)15)18-24(21,22)13-2-1-12(16)23-13/h1-6,18H,7H2
Affinity DataKi:  12.6nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401553(CHEMBL2207085)
Show SMILES Cn1nnnc1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl3N5O2S/c1-23-15(19-21-22-23)6-9-2-3-10(16)7-14(9)20-26(24,25)11-4-5-12(17)13(18)8-11/h2-5,7-8,20H,6H2,1H3
Affinity DataKi:  15.8nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401557(CHEMBL2207099)
Show SMILES Cn1nnnc1Cc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C14H11Cl3N6O2S/c1-23-14(19-21-22-23)6-12-13(4-8(15)7-18-12)20-26(24,25)9-2-3-10(16)11(17)5-9/h2-5,7,20H,6H2,1H3
Affinity DataKi:  25.1nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401548(CHEMBL2207094)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C13H9Cl3N4O2S2/c14-9-2-1-8(7-20-4-3-17-19-20)11(5-9)18-24(21,22)12-6-10(15)13(16)23-12/h1-6,18H,7H2
Affinity DataKi:  25.1nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401558(CHEMBL2207097)
Show SMILES Fc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl2FN4O2S/c16-13-4-3-12(8-14(13)17)25(23,24)20-15-7-11(18)2-1-10(15)9-22-6-5-19-21-22/h1-8,20H,9H2
Affinity DataKi:  31.6nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401552(CHEMBL2207080)
Show SMILES Clc1ccc(Cn2nnnc2C2CC2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C17H14Cl3N5O2S/c18-12-4-3-11(9-25-17(10-1-2-10)21-23-24-25)16(7-12)22-28(26,27)13-5-6-14(19)15(20)8-13/h3-8,10,22H,1-2,9H2
Affinity DataKi:  31.6nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401554(CHEMBL2207083)
Show SMILES Clc1ccc(Cn2cncn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(7-22-9-19-8-20-22)15(5-11)21-25(23,24)12-3-4-13(17)14(18)6-12/h1-6,8-9,21H,7H2
Affinity DataKi:  39.8nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401559(CHEMBL2207093)
Show SMILES Clc1ccc(s1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C13H10Cl2N4O2S2/c14-10-2-1-9(8-19-6-5-16-18-19)11(7-10)17-23(20,21)13-4-3-12(15)22-13/h1-7,17H,8H2
Affinity DataKi:  50.1nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401556(CHEMBL2207091)
Show SMILES FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C16H12ClF3N4O2S/c17-13-5-4-11(10-24-7-6-21-23-24)15(9-13)22-27(25,26)14-3-1-2-12(8-14)16(18,19)20/h1-9,22H,10H2
Affinity DataKi:  50.1nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401564(CHEMBL2207095)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2csc3ccccc23)c1
Show InChI InChI=1S/C17H13ClN4O2S2/c18-13-6-5-12(10-22-8-7-19-21-22)15(9-13)20-26(23,24)17-11-25-16-4-2-1-3-14(16)17/h1-9,11,20H,10H2
Affinity DataKi:  63.1nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401550(CHEMBL2207084)
Show SMILES Cc1nnnn1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl3N5O2S/c1-9-19-21-22-23(9)8-10-2-3-11(16)6-15(10)20-26(24,25)12-4-5-13(17)14(18)7-12/h2-7,20H,8H2,1H3
Affinity DataKi:  79.4nMAssay Description:Antagonist activity at CCR2 assessed as inhibition of CCL2-stimulated THP-1 cell chemotaxis in presence of 1% human serumMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401550(CHEMBL2207084)
Show SMILES Cc1nnnn1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl3N5O2S/c1-9-19-21-22-23(9)8-10-2-3-11(16)6-15(10)20-26(24,25)12-4-5-13(17)14(18)7-12/h2-7,20H,8H2,1H3
Affinity DataKi:  79.4nMAssay Description:Antagonist activity at CCR2 assessed as inhibition of CCL2-stimulated THP-1 cell chemotaxis in presence of 0.1% human serumMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401549(CHEMBL2207081)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(9-22-6-5-19-21-22)15(7-11)20-25(23,24)12-3-4-13(17)14(18)8-12/h1-8,20H,9H2
Affinity DataKi:  79.4nMAssay Description:Antagonist activity at CCR2 assessed as inhibition of CCL2-stimulated THP-1 cell chemotaxis in presence of 0.1% human serumMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401549(CHEMBL2207081)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(9-22-6-5-19-21-22)15(7-11)20-25(23,24)12-3-4-13(17)14(18)8-12/h1-8,20H,9H2
Affinity DataKi:  100nMAssay Description:Antagonist activity at CCR2 assessed as inhibition of CCL2-stimulated THP-1 cell chemotaxis in presence of 1% human serumMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401560(CHEMBL2207087)
Show SMILES Clc1ccc(cc1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C15H12Cl2N4O2S/c16-12-3-5-14(6-4-12)24(22,23)19-15-9-13(17)2-1-11(15)10-21-8-7-18-20-21/h1-9,19H,10H2
Affinity DataKi:  100nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401562(CHEMBL2207088)
Show SMILES Clc1cccc(c1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C15H12Cl2N4O2S/c16-12-2-1-3-14(8-12)24(22,23)19-15-9-13(17)5-4-11(15)10-21-7-6-18-20-21/h1-9,19H,10H2
Affinity DataKi:  100nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401565(CHEMBL2207090)
Show SMILES Fc1cccc(c1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C15H12ClFN4O2S/c16-12-5-4-11(10-21-7-6-18-20-21)15(8-12)19-24(22,23)14-3-1-2-13(17)9-14/h1-9,19H,10H2
Affinity DataKi:  100nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401552(CHEMBL2207080)
Show SMILES Clc1ccc(Cn2nnnc2C2CC2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C17H14Cl3N5O2S/c18-12-4-3-11(9-25-17(10-1-2-10)21-23-24-25)16(7-12)22-28(26,27)13-5-6-14(19)15(20)8-13/h3-8,10,22H,1-2,9H2
Affinity DataKi:  100nMAssay Description:Antagonist activity at CCR2 assessed as inhibition of CCL2-stimulated THP-1 cell chemotaxis in presence of 0.1% human serumMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401552(CHEMBL2207080)
Show SMILES Clc1ccc(Cn2nnnc2C2CC2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C17H14Cl3N5O2S/c18-12-4-3-11(9-25-17(10-1-2-10)21-23-24-25)16(7-12)22-28(26,27)13-5-6-14(19)15(20)8-13/h3-8,10,22H,1-2,9H2
Affinity DataKi:  100nMAssay Description:Antagonist activity at CCR2 assessed as inhibition of CCL2-stimulated THP-1 cell chemotaxis in presence of 1% human serumMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401547(CHEMBL2207098)
Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C15H10Cl4N4O2S/c16-11-2-1-10(6-13(11)18)26(24,25)21-15-7-14(19)12(17)5-9(15)8-23-4-3-20-22-23/h1-7,21H,8H2
Affinity DataKi:  158nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401567(CHEMBL2207096)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2cccc3nonc23)c1
Show InChI InChI=1S/C15H11ClN6O3S/c16-11-5-4-10(9-22-7-6-17-21-22)13(8-11)20-26(23,24)14-3-1-2-12-15(14)19-25-18-12/h1-8,20H,9H2
Affinity DataKi:  251nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401546(CHEMBL2207100)
Show SMILES Clc1ccc(s1)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C13H9Cl3N4O2S2/c14-9-5-8(7-20-4-3-17-19-20)11(6-10(9)15)18-24(21,22)13-2-1-12(16)23-13/h1-6,18H,7H2
Affinity DataKi:  316nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401547(CHEMBL2207098)
Show SMILES Clc1ccc(cc1Cl)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C15H10Cl4N4O2S/c16-11-2-1-10(6-13(11)18)26(24,25)21-15-7-14(19)12(17)5-9(15)8-23-4-3-20-22-23/h1-7,21H,8H2
Affinity DataKi:  316nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401549(CHEMBL2207081)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(9-22-6-5-19-21-22)15(7-11)20-25(23,24)12-3-4-13(17)14(18)8-12/h1-8,20H,9H2
Affinity DataKi:  398nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401549(CHEMBL2207081)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(9-22-6-5-19-21-22)15(7-11)20-25(23,24)12-3-4-13(17)14(18)8-12/h1-8,20H,9H2
Affinity DataKi:  398nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401550(CHEMBL2207084)
Show SMILES Cc1nnnn1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl3N5O2S/c1-9-19-21-22-23(9)8-10-2-3-11(16)6-15(10)20-26(24,25)12-4-5-13(17)14(18)7-12/h2-7,20H,8H2,1H3
Affinity DataKi:  398nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401548(CHEMBL2207094)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C13H9Cl3N4O2S2/c14-9-2-1-8(7-20-4-3-17-19-20)11(5-9)18-24(21,22)12-6-10(15)13(16)23-12/h1-6,18H,7H2
Affinity DataKi:  398nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401548(CHEMBL2207094)
Show SMILES Clc1cc(sc1Cl)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C13H9Cl3N4O2S2/c14-9-2-1-8(7-20-4-3-17-19-20)11(5-9)18-24(21,22)12-6-10(15)13(16)23-12/h1-6,18H,7H2
Affinity DataKi:  501nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401546(CHEMBL2207100)
Show SMILES Clc1ccc(s1)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C13H9Cl3N4O2S2/c14-9-5-8(7-20-4-3-17-19-20)11(6-10(9)15)18-24(21,22)13-2-1-12(16)23-13/h1-6,18H,7H2
Affinity DataKi:  501nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401551(CHEMBL2207089)
Show SMILES Cc1ccc(cc1C)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C17H17ClN4O2S/c1-12-3-6-16(9-13(12)2)25(23,24)20-17-10-15(18)5-4-14(17)11-22-8-7-19-21-22/h3-10,20H,11H2,1-2H3
Affinity DataKi:  501nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401551(CHEMBL2207089)
Show SMILES Cc1ccc(cc1C)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C17H17ClN4O2S/c1-12-3-6-16(9-13(12)2)25(23,24)20-17-10-15(18)5-4-14(17)11-22-8-7-19-21-22/h3-10,20H,11H2,1-2H3
Affinity DataKi:  501nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401552(CHEMBL2207080)
Show SMILES Clc1ccc(Cn2nnnc2C2CC2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C17H14Cl3N5O2S/c18-12-4-3-11(9-25-17(10-1-2-10)21-23-24-25)16(7-12)22-28(26,27)13-5-6-14(19)15(20)8-13/h3-8,10,22H,1-2,9H2
Affinity DataKi:  501nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401568(CHEMBL2207079)
Show SMILES Cc1cc(C)n(Cc2ccc(cc2NS(=O)(=O)c2ccc(Cl)cc2)C(F)(F)F)n1
Show InChI InChI=1S/C19H17ClF3N3O2S/c1-12-9-13(2)26(24-12)11-14-3-4-15(19(21,22)23)10-18(14)25-29(27,28)17-7-5-16(20)6-8-17/h3-10,25H,11H2,1-2H3
Affinity DataKi:  501nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401554(CHEMBL2207083)
Show SMILES Clc1ccc(Cn2cncn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(7-22-9-19-8-20-22)15(5-11)21-25(23,24)12-3-4-13(17)14(18)6-12/h1-6,8-9,21H,7H2
Affinity DataKi:  631nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401553(CHEMBL2207085)
Show SMILES Cn1nnnc1Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H12Cl3N5O2S/c1-23-15(19-21-22-23)6-9-2-3-10(16)7-14(9)20-26(24,25)11-4-5-12(17)13(18)8-11/h2-5,7-8,20H,6H2,1H3
Affinity DataKi:  631nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401561(CHEMBL2207082)
Show SMILES Clc1ccc(Cn2cnnc2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(7-22-8-19-20-9-22)15(5-11)21-25(23,24)12-3-4-13(17)14(18)6-12/h1-6,8-9,21H,7H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401554(CHEMBL2207083)
Show SMILES Clc1ccc(Cn2cncn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl3N4O2S/c16-11-2-1-10(7-22-9-19-8-20-22)15(5-11)21-25(23,24)12-3-4-13(17)14(18)6-12/h1-6,8-9,21H,7H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401560(CHEMBL2207087)
Show SMILES Clc1ccc(cc1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C15H12Cl2N4O2S/c16-12-3-5-14(6-4-12)24(22,23)19-15-9-13(17)2-1-11(15)10-21-8-7-18-20-21/h1-9,19H,10H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401555(CHEMBL2207101)
Show SMILES FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1cc(Cl)c(Cl)cc1Cn1ccnn1
Show InChI InChI=1S/C16H11Cl2F3N4O2S/c17-13-6-10(9-25-5-4-22-24-25)15(8-14(13)18)23-28(26,27)12-3-1-2-11(7-12)16(19,20)21/h1-8,23H,9H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 4(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401556(CHEMBL2207091)
Show SMILES FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C16H12ClF3N4O2S/c17-13-5-4-11(10-24-7-6-21-23-24)15(9-13)22-27(25,26)14-3-1-2-12(8-14)16(18,19)20/h1-9,22H,10H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR4 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401557(CHEMBL2207099)
Show SMILES Cn1nnnc1Cc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C14H11Cl3N6O2S/c1-23-14(19-21-22-23)6-12-13(4-8(15)7-18-12)20-26(24,25)9-2-3-10(16)11(17)5-9/h2-5,7,20H,6H2,1H3
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401558(CHEMBL2207097)
Show SMILES Fc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C15H11Cl2FN4O2S/c16-13-4-3-12(8-14(13)17)25(23,24)20-15-7-11(18)2-1-10(15)9-22-6-5-19-21-22/h1-8,20H,9H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 1(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401559(CHEMBL2207093)
Show SMILES Clc1ccc(s1)S(=O)(=O)Nc1cc(Cl)ccc1Cn1ccnn1
Show InChI InChI=1S/C13H10Cl2N4O2S2/c14-10-2-1-9(8-19-6-5-16-18-19)11(7-10)17-23(20,21)13-4-3-12(15)22-13/h1-7,17H,8H2
Affinity DataKi:  1.00E+3nMAssay Description:Binding affinity to CCR1 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
TargetC-C chemokine receptor type 2(Homo sapiens (Human))
GlaxoSmithKline

Curated by ChEMBL
LigandPNGBDBM50401563(CHEMBL2207086)
Show SMILES Clc1ccc(Cn2ccnn2)c(NS(=O)(=O)c2ccccc2)c1
Show InChI InChI=1S/C15H13ClN4O2S/c16-13-7-6-12(11-20-9-8-17-19-20)15(10-13)18-23(21,22)14-4-2-1-3-5-14/h1-10,18H,11H2
Affinity DataKi:  1.26E+3nMAssay Description:Binding affinity to CCR2 by 35S-gamma-GTP membrane assayMore data for this Ligand-Target Pair
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