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PubMed code 15908209

Compile data set for download or QSAR
Found 25 hits of Enzyme Inhibition Constant Data   
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
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167438
PNG
(CHEMBL191464 | Quinoline-6-carboxylic acid [1'-(3,...)
Show SMILES CC1CN(Cc2ccc(Cl)c(Cl)c2)CCC1N1CCCC(CNC(=O)c2ccc3ncccc3c2)C1
Show InChI InChI=1S/C29H34Cl2N4O/c1-20-17-34(18-21-6-8-25(30)26(31)14-21)13-10-28(20)35-12-3-4-22(19-35)16-33-29(36)24-7-9-27-23(15-24)5-2-11-32-27/h2,5-9,11,14-15,20,22,28H,3-4,10,12-13,16-19H2,1H3,(H,33,36)
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 7.30n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167436
PNG
(CHEMBL426089 | Quinoline-6-carboxylic acid [1'-(3,...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)cc1Cl
Show InChI InChI=1S/C28H32Cl2N4O/c29-25-7-5-20(15-26(25)30)18-33-13-9-24(10-14-33)34-12-2-3-21(19-34)17-32-28(35)23-6-8-27-22(16-23)4-1-11-31-27/h1,4-8,11,15-16,21,24H,2-3,9-10,12-14,17-19H2,(H,32,35)
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 23n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167442
PNG
(1H-Indole-5-carboxylic acid [1'-(3,4-dichloro-benz...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4[nH]ccc4c3)C2)cc1Cl
Show InChI InChI=1S/C27H32Cl2N4O/c28-24-5-3-19(14-25(24)29)17-32-12-8-23(9-13-32)33-11-1-2-20(18-33)16-31-27(34)22-4-6-26-21(15-22)7-10-30-26/h3-7,10,14-15,20,23,30H,1-2,8-9,11-13,16-18H2,(H,31,34)
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 29n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167454
PNG
(CHEMBL193354 | Quinoline-8-carboxylic acid [1'-(3,...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3cccc4cccnc34)C2)cc1Cl
Show InChI InChI=1S/C28H32Cl2N4O/c29-25-9-8-20(16-26(25)30)18-33-14-10-23(11-15-33)34-13-3-4-21(19-34)17-32-28(35)24-7-1-5-22-6-2-12-31-27(22)24/h1-2,5-9,12,16,21,23H,3-4,10-11,13-15,17-19H2,(H,32,35)
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 30n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167454
PNG
(CHEMBL193354 | Quinoline-8-carboxylic acid [1'-(3,...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3cccc4cccnc34)C2)cc1Cl
Show InChI InChI=1S/C28H32Cl2N4O/c29-25-9-8-20(16-26(25)30)18-33-14-10-23(11-15-33)34-13-3-4-21(19-34)17-32-28(35)24-7-1-5-22-6-2-12-31-27(22)24/h1-2,5-9,12,16,21,23H,3-4,10-11,13-15,17-19H2,(H,32,35)
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 30n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167439
PNG
(CHEMBL189206 | Isoquinoline-1-carboxylic acid [1'-...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3nccc4ccccc34)C2)cc1Cl
Show InChI InChI=1S/C28H32Cl2N4O/c29-25-8-7-20(16-26(25)30)18-33-14-10-23(11-15-33)34-13-3-4-21(19-34)17-32-28(35)27-24-6-2-1-5-22(24)9-12-31-27/h1-2,5-9,12,16,21,23H,3-4,10-11,13-15,17-19H2,(H,32,35)
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 34n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167435
PNG
(1H-Indole-4-carboxylic acid [1'-(3,4-dichloro-benz...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3cccc4[nH]ccc34)C2)cc1Cl
Show InChI InChI=1S/C27H32Cl2N4O/c28-24-7-6-19(15-25(24)29)17-32-13-9-21(10-14-32)33-12-2-3-20(18-33)16-31-27(34)23-4-1-5-26-22(23)8-11-30-26/h1,4-8,11,15,20-21,30H,2-3,9-10,12-14,16-18H2,(H,31,34)
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 36n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167452
PNG
(1H-Benzoimidazole-5-carboxylic acid [1'-(3,4-dichl...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4nc[nH]c4c3)C2)cc1Cl
Show InChI InChI=1S/C26H31Cl2N5O/c27-22-5-3-18(12-23(22)28)15-32-10-7-21(8-11-32)33-9-1-2-19(16-33)14-29-26(34)20-4-6-24-25(13-20)31-17-30-24/h3-6,12-13,17,19,21H,1-2,7-11,14-16H2,(H,29,34)(H,30,31)
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 47n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167449
PNG
(CHEMBL366199 | Naphthalene-2-carboxylic acid [1'-(...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ccccc4c3)C2)cc1Cl
Show InChI InChI=1S/C29H33Cl2N3O/c30-27-10-7-21(16-28(27)31)19-33-14-11-26(12-15-33)34-13-3-4-22(20-34)18-32-29(35)25-9-8-23-5-1-2-6-24(23)17-25/h1-2,5-10,16-17,22,26H,3-4,11-15,18-20H2,(H,32,35)
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 48n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167455
PNG
(CHEMBL190149 | Quinoline-6-carboxylic acid [1'-(3,...)
Show SMILES CC1(CCN(Cc2ccc(Cl)c(Cl)c2)CC1)N1CCCC(CNC(=O)c2ccc3ncccc3c2)C1
Show InChI InChI=1S/C29H34Cl2N4O/c1-29(10-14-34(15-11-29)19-21-6-8-25(30)26(31)16-21)35-13-3-4-22(20-35)18-33-28(36)24-7-9-27-23(17-24)5-2-12-32-27/h2,5-9,12,16-17,22H,3-4,10-11,13-15,18-20H2,1H3,(H,33,36)
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 50n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167445
PNG
(CHEMBL372868 | Naphthalene-1-carboxylic acid [1'-(...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3cccc4ccccc34)C2)cc1Cl
Show InChI InChI=1S/C29H33Cl2N3O/c30-27-11-10-21(17-28(27)31)19-33-15-12-24(13-16-33)34-14-4-5-22(20-34)18-32-29(35)26-9-3-7-23-6-1-2-8-25(23)26/h1-3,6-11,17,22,24H,4-5,12-16,18-20H2,(H,32,35)
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 58n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167447
PNG
(CHEMBL187779 | N-[1'-(3,4-Dichloro-benzyl)-[1,4']b...)
Show SMILES Cc1ccccc1C(=O)NCC1CCCN(C1)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
Show InChI InChI=1S/C26H33Cl2N3O/c1-19-5-2-3-7-23(19)26(32)29-16-21-6-4-12-31(18-21)22-10-13-30(14-11-22)17-20-8-9-24(27)25(28)15-20/h2-3,5,7-9,15,21-22H,4,6,10-14,16-18H2,1H3,(H,29,32)
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 60n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167444
PNG
(CHEMBL192757 | Quinoline-6-carboxylic acid {1'-[1-...)
Show SMILES CC(N1CCC(CC1)N1CCCC(CNC(=O)c2ccc3ncccc3c2)C1)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C29H34Cl2N4O/c1-20(22-6-8-26(30)27(31)17-22)34-14-10-25(11-15-34)35-13-3-4-21(19-35)18-33-29(36)24-7-9-28-23(16-24)5-2-12-32-28/h2,5-9,12,16-17,20-21,25H,3-4,10-11,13-15,18-19H2,1H3,(H,33,36)
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 74.3n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167441
PNG
(CHEMBL190852 | Quinoline-4-carboxylic acid [1'-(3,...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccnc4ccccc34)C2)cc1Cl
Show InChI InChI=1S/C28H32Cl2N4O/c29-25-8-7-20(16-26(25)30)18-33-14-10-22(11-15-33)34-13-3-4-21(19-34)17-32-28(35)24-9-12-31-27-6-2-1-5-23(24)27/h1-2,5-9,12,16,21-22H,3-4,10-11,13-15,17-19H2,(H,32,35)
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 80n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167433
PNG
(CHEMBL189917 | N-[1'-(3,4-Dichloro-benzyl)-[1,4']b...)
Show SMILES Cc1ccccc1CC(=O)NCC1CCCN(C1)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
Show InChI InChI=1S/C27H35Cl2N3O/c1-20-5-2-3-7-23(20)16-27(33)30-17-22-6-4-12-32(19-22)24-10-13-31(14-11-24)18-21-8-9-25(28)26(29)15-21/h2-3,5,7-9,15,22,24H,4,6,10-14,16-19H2,1H3,(H,30,33)
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 86n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167434
PNG
(CHEMBL190646 | N-[1'-(3,4-Dichloro-benzyl)-[1,4']b...)
Show SMILES COc1ccccc1C(=O)NCC1CCCN(C1)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
Show InChI InChI=1S/C26H33Cl2N3O2/c1-33-25-7-3-2-6-22(25)26(32)29-16-20-5-4-12-31(18-20)21-10-13-30(14-11-21)17-19-8-9-23(27)24(28)15-19/h2-3,6-9,15,20-21H,4-5,10-14,16-18H2,1H3,(H,29,32)
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 92n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167448
PNG
(CHEMBL190362 | Quinoline-6-carboxylic acid [1'-(4-...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)cc1
Show InChI InChI=1S/C28H33ClN4O/c29-25-8-5-21(6-9-25)19-32-15-11-26(12-16-32)33-14-2-3-22(20-33)18-31-28(34)24-7-10-27-23(17-24)4-1-13-30-27/h1,4-10,13,17,22,26H,2-3,11-12,14-16,18-20H2,(H,31,34)
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 95n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167440
PNG
(CHEMBL190048 | Cinnoline-4-carboxylic acid [1'-(3,...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3cnnc4ccccc34)C2)cc1Cl
Show InChI InChI=1S/C27H31Cl2N5O/c28-24-8-7-19(14-25(24)29)17-33-12-9-21(10-13-33)34-11-3-4-20(18-34)15-30-27(35)23-16-31-32-26-6-2-1-5-22(23)26/h1-2,5-8,14,16,20-21H,3-4,9-13,15,17-18H2,(H,30,35)
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 99n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167446
PNG
(CHEMBL191418 | Cyclohexanecarboxylic acid [1'-(3,4...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)C3CCCCC3)C2)cc1Cl
Show InChI InChI=1S/C25H37Cl2N3O/c26-23-9-8-19(15-24(23)27)17-29-13-10-22(11-14-29)30-12-4-5-20(18-30)16-28-25(31)21-6-2-1-3-7-21/h8-9,15,20-22H,1-7,10-14,16-18H2,(H,28,31)
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 107n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167453
PNG
(CHEMBL189680 | Quinoline-6-carboxylic acid {1'-[2-...)
Show SMILES Clc1ccc(CCN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)cc1Cl
Show InChI InChI=1S/C29H34Cl2N4O/c30-26-7-5-21(17-27(26)31)9-14-34-15-10-25(11-16-34)35-13-2-3-22(20-35)19-33-29(36)24-6-8-28-23(18-24)4-1-12-32-28/h1,4-8,12,17-18,22,25H,2-3,9-11,13-16,19-20H2,(H,33,36)
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 180n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167443
PNG
(CHEMBL192584 | Quinoline-6-carboxylic acid [1'-(2,...)
Show SMILES Clc1ccc(Cl)c(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)c1
Show InChI InChI=1S/C28H32Cl2N4O/c29-24-6-7-26(30)23(16-24)19-33-13-9-25(10-14-33)34-12-2-3-20(18-34)17-32-28(35)22-5-8-27-21(15-22)4-1-11-31-27/h1,4-8,11,15-16,20,25H,2-3,9-10,12-14,17-19H2,(H,32,35)
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 391n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167450
PNG
(CHEMBL190894 | Quinoline-6-carboxylic acid [1'-(3,...)
Show SMILES Clc1cc(Cl)cc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)c1
Show InChI InChI=1S/C28H32Cl2N4O/c29-24-13-21(14-25(30)16-24)18-33-11-7-26(8-12-33)34-10-2-3-20(19-34)17-32-28(35)23-5-6-27-22(15-23)4-1-9-31-27/h1,4-6,9,13-16,20,26H,2-3,7-8,10-12,17-19H2,(H,32,35)
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 398n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167437
PNG
(CHEMBL189158 | N-[1'-(3,4-Dichloro-benzyl)-[1,4']b...)
Show SMILES CC(=O)NCC1CCCN(C1)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
Show InChI InChI=1S/C20H29Cl2N3O/c1-15(26)23-12-17-3-2-8-25(14-17)18-6-9-24(10-7-18)13-16-4-5-19(21)20(22)11-16/h4-5,11,17-18H,2-3,6-10,12-14H2,1H3,(H,23,26)
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 533n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167451
PNG
(CHEMBL190312 | Quinoline-6-carboxylic acid {1'-[2-...)
Show SMILES Clc1ccc(CC(=O)N2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)cc1Cl
Show InChI InChI=1S/C29H32Cl2N4O2/c30-25-7-5-20(15-26(25)31)16-28(36)34-13-9-24(10-14-34)35-12-2-3-21(19-35)18-33-29(37)23-6-8-27-22(17-23)4-1-11-32-27/h1,4-8,11,15,17,21,24H,2-3,9-10,12-14,16,18-19H2,(H,33,37)
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 767n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding activity against C-C chemokine receptor type 3 using [35S]-GTP-gammaS, as radioligand

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM50167436
PNG
(CHEMBL426089 | Quinoline-6-carboxylic acid [1'-(3,...)
Show SMILES Clc1ccc(CN2CCC(CC2)N2CCCC(CNC(=O)c3ccc4ncccc4c3)C2)cc1Cl
Show InChI InChI=1S/C28H32Cl2N4O/c29-25-7-5-20(15-26(25)30)18-33-13-9-24(10-14-33)34-12-2-3-21(19-34)17-32-28(35)23-6-8-27-22(16-23)4-1-11-31-27/h1,4-8,11,15-16,21,24H,2-3,9-10,12-14,17-19H2,(H,32,35)
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n/an/a 136n/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against BaF3 cell line expressed recombinant human CCR3 using the LDH assay

Bioorg Med Chem Lett 15: 3020-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.054
BindingDB Entry DOI: 10.7270/Q23T9GRW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%