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Compile Data Set for Download or QSAR

Found 3165 hits Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 2'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 12n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as pEC50 for CCL2-stimulated [35S]GT...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 13n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as pEC50 for CCL2-stimulated [35S]GT...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 13n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as EC50 for CCL2-stimulated [35S]GTP...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 13n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as EC50 for CCL2-stimulated [35S]GTP...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50236430
PNG
((R)-N-(2-(1-(4-chlorobenzyl)pyrrolidin-3-ylamino)-...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@@H]1CCN(Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C21H21ClF3N3O2/c22-17-6-4-14(5-7-17)12-28-9-8-18(13-28)27-19(29)11-26-20(30)15-2-1-3-16(10-15)21(23,24)25/h1-7,10,18H,8-9,11-13H2,(H,26,30)(H,27,29)/t18-/m1/s1
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n/an/an/an/a 20n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 25n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as pEC50 for CCL2-stimulated [35S]GT...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 26n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as EC50 for CCL2-stimulated [35S]GTP...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 30n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as pEC50 for CCL2-stimulated [35S]GT...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 32n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as EC50 for CCL2-stimulated [35S]GTP...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50153942
PNG
(CHEMBL435499 | N-({[1-(4-Chloro-benzyl)-piperidin-...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NCC1CCN(Cc2ccc(Cl)cc2)CC1
Show InChI InChI=1S/C23H25ClF3N3O2/c24-20-6-4-17(5-7-20)15-30-10-8-16(9-11-30)13-28-21(31)14-29-22(32)18-2-1-3-19(12-18)23(25,26)27/h1-7,12,16H,8-11,13-15H2,(H,28,31)(H,29,32)
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n/an/an/an/a 40n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 54n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as pEC50 for CCL2-stimulated [35S]GT...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 56n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as EC50 for CCL2-stimulated [35S]GTP...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 135n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as pEC50 for CCL2-stimulated [35S]GT...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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n/an/an/an/a 148n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Non-competitive insurmountable antagonist activity at human CCR2 expressed in human U2OS cell membranes assessed as EC50 for CCL2-stimulated [35S]GTP...


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50409951
PNG
(CHEMBL2096789)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@H]1CCN(Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C21H21ClF3N3O2/c22-17-6-4-14(5-7-17)12-28-9-8-18(13-28)27-19(29)11-26-20(30)15-2-1-3-16(10-15)21(23,24)25/h1-7,10,18H,8-9,11-13H2,(H,26,30)(H,27,29)/t18-/m0/s1
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n/an/an/an/a 360n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50153938
PNG
(CHEMBL181432 | N-{[1-(4-Chloro-benzyl)-piperidin-3...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NC1CCCN(Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C22H23ClF3N3O2/c23-18-8-6-15(7-9-18)13-29-10-2-5-19(14-29)28-20(30)12-27-21(31)16-3-1-4-17(11-16)22(24,25)26/h1,3-4,6-9,11,19H,2,5,10,12-14H2,(H,27,31)(H,28,30)
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n/an/an/an/a 610n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50409950
PNG
(CHEMBL2096788)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NC[C@H]1CCCN1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C22H23ClF3N3O2/c23-18-8-6-15(7-9-18)14-29-10-2-5-19(29)12-27-20(30)13-28-21(31)16-3-1-4-17(11-16)22(24,25)26/h1,3-4,6-9,11,19H,2,5,10,12-14H2,(H,27,30)(H,28,31)/t19-/m1/s1
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n/an/an/an/a 630n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50409950
PNG
(CHEMBL2096788)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NC[C@H]1CCCN1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C22H23ClF3N3O2/c23-18-8-6-15(7-9-18)14-29-10-2-5-19(29)12-27-20(30)13-28-21(31)16-3-1-4-17(11-16)22(24,25)26/h1,3-4,6-9,11,19H,2,5,10,12-14H2,(H,27,30)(H,28,31)/t19-/m1/s1
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n/an/an/an/a 810n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50255479
PNG
(CHEMBL4067429)
Show SMILES CC1=CCC[C@H]1NC(=O)Nc1ccc(Cl)c(c1O)S(=O)(=O)[C@@]1(C)CCOC1
Show InChI InChI=1S/C18H23ClN2O5S/c1-11-4-3-5-13(11)20-17(23)21-14-7-6-12(19)16(15(14)22)27(24,25)18(2)8-9-26-10-18/h4,6-7,13,22H,3,5,8-10H2,1-2H3,(H2,20,21,23)/t13-,18+/m1/s1
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n/an/an/an/a>1.00E+4n/an/an/an/a



GSK Pharmaceuticals R & D

Curated by ChEMBL


Assay Description
Antagonist activity at CXCR2 in human whole blood assessed as inhibition of GROalpha-stimulated CD11b upregulation preincubated for 15 mins followed ...


J Med Chem 61: 2518-2532 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01854
BindingDB Entry DOI: 10.7270/Q2959M1F
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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0.380n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506145
PNG
(CHEMBL4483373)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3ccc(Cl)c(Cl)c3)c(=O)n2n1
Show InChI InChI=1S/C15H13Cl2N5O/c16-10-4-1-7(6-11(10)17)5-9-12(8-2-3-8)19-15-20-14(18)21-22(15)13(9)23/h1,4,6,8H,2-3,5H2,(H3,18,19,20,21)
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0.400n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506124
PNG
(CHEMBL4544504)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Br)c1
Show InChI InChI=1S/C15H15BrClN5O/c1-7(2)12-9(5-8-3-4-11(17)10(16)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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0.400n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506145
PNG
(CHEMBL4483373)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3ccc(Cl)c(Cl)c3)c(=O)n2n1
Show InChI InChI=1S/C15H13Cl2N5O/c16-10-4-1-7(6-11(10)17)5-9-12(8-2-3-8)19-15-20-14(18)21-22(15)13(9)23/h1,4,6,8H,2-3,5H2,(H3,18,19,20,21)
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0.447n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50077906
PNG
(CHEMBL3305901)
Show SMILES CO[C@@H]1COCC[C@@H]1N[C@@H]1CC[C@](C1)(C(C)C)C(=O)N1CCc2ncc(cc2C1)C(F)(F)F
Show InChI InChI=1S/C24H34F3N3O3/c1-15(2)23(7-4-18(11-23)29-20-6-9-33-14-21(20)32-3)22(31)30-8-5-19-16(13-30)10-17(12-28-19)24(25,26)27/h10,12,15,18,20-21,29H,4-9,11,13-14H2,1-3H3/t18-,20+,21-,23+/m1/s1
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0.550n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of 0.1 nM [125I]CCL2 from human CCR2 expressing human U2OS cell membrane by scintillation spectrometry


Eur J Med Chem 93: 121-34 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.063
BindingDB Entry DOI: 10.7270/Q25M67DX
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50428327
PNG
(CHEMBL2338392)
Show SMILES CO[C@@H]1COCC[C@@H]1NC1CCN(CC1)C(=O)c1nc(CF)nc(Nc2ccc(Cl)c(Cl)c2)c1C
Show InChI InChI=1S/C24H30Cl2FN5O3/c1-14-22(30-21(12-27)31-23(14)29-16-3-4-17(25)18(26)11-16)24(33)32-8-5-15(6-9-32)28-19-7-10-35-13-20(19)34-2/h3-4,11,15,19-20,28H,5-10,12-13H2,1-2H3,(H,29,30,31)/t19-,20+/m0/s1
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0.600n/an/an/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Displacement of [125I]MCP1 from CCR2 in human THP1 cell membranes after 8 hrs by scintillation counting analysis


ACS Med Chem Lett 4: 371-2 (2013)


Article DOI: 10.1021/ml400055e
BindingDB Entry DOI: 10.7270/Q2B859FX
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506146
PNG
(CHEMBL4548396)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(5-8-3-4-10(16)11(17)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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0.600n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506146
PNG
(CHEMBL4548396)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(5-8-3-4-10(16)11(17)6-8)13(23)22-15(19-12)20-14(18)21-22/h3-4,6-7H,5H2,1-2H3,(H3,18,19,20,21)
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0.603n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506119
PNG
(CHEMBL4577171)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3cccc(Br)c3)c(=O)n2n1
Show InChI InChI=1S/C15H14BrN5O/c16-10-3-1-2-8(6-10)7-11-12(9-4-5-9)18-15-19-14(17)20-21(15)13(11)22/h1-3,6,9H,4-5,7H2,(H3,17,18,19,20)
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0.832n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506132
PNG
(CHEMBL4571719)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3cccc(I)c3)c(=O)n2n1
Show InChI InChI=1S/C15H14IN5O/c16-10-3-1-2-8(6-10)7-11-12(9-4-5-9)18-15-19-14(17)20-21(15)13(11)22/h1-3,6,9H,4-5,7H2,(H3,17,18,19,20)
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0.871n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506119
PNG
(CHEMBL4577171)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3cccc(Br)c3)c(=O)n2n1
Show InChI InChI=1S/C15H14BrN5O/c16-10-3-1-2-8(6-10)7-11-12(9-4-5-9)18-15-19-14(17)20-21(15)13(11)22/h1-3,6,9H,4-5,7H2,(H3,17,18,19,20)
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0.900n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506132
PNG
(CHEMBL4571719)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3cccc(I)c3)c(=O)n2n1
Show InChI InChI=1S/C15H14IN5O/c16-10-3-1-2-8(6-10)7-11-12(9-4-5-9)18-15-19-14(17)20-21(15)13(11)22/h1-3,6,9H,4-5,7H2,(H3,17,18,19,20)
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0.900n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50428328
PNG
(CHEMBL2338391)
Show SMILES Cc1c(NC[C@H]2CCC[C@H](O2)c2ccc(cc2)C(F)(F)F)nc(nc1C(=O)N1CCC(CC1)N[C@H]1CCOC[C@H]1F)C1CCOCC1
Show InChI InChI=1S/C34H45F4N5O4/c1-21-30(33(44)43-14-9-25(10-15-43)40-28-13-18-46-20-27(28)35)41-32(23-11-16-45-17-12-23)42-31(21)39-19-26-3-2-4-29(47-26)22-5-7-24(8-6-22)34(36,37)38/h5-8,23,25-29,40H,2-4,9-20H2,1H3,(H,39,41,42)/t26-,27-,28+,29+/m1/s1
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1n/an/an/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Displacement of [125I]MCP1 from CCR2 in human THP1 cell membranes after 8 hrs by scintillation counting analysis


ACS Med Chem Lett 4: 371-2 (2013)


Article DOI: 10.1021/ml400055e
BindingDB Entry DOI: 10.7270/Q2B859FX
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50428326
PNG
(CHEMBL2338393)
Show SMILES Cc1cc(no1)-c1nc(NC[C@H]2CCC[C@H](O2)c2ccc(cc2)C(F)(F)F)c(C)c(n1)C(=O)N1CCC(CC1)N[C@@H]1CCOC[C@@H]1F
Show InChI InChI=1S/C33H40F4N6O4/c1-19-16-27(42-47-19)31-40-29(32(44)43-13-10-23(11-14-43)39-26-12-15-45-18-25(26)34)20(2)30(41-31)38-17-24-4-3-5-28(46-24)21-6-8-22(9-7-21)33(35,36)37/h6-9,16,23-26,28,39H,3-5,10-15,17-18H2,1-2H3,(H,38,40,41)/t24-,25+,26-,28+/m1/s1
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1n/an/an/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Displacement of [125I]MCP1 from CCR2 in human THP1 cell membranes after 8 hrs by scintillation counting analysis


ACS Med Chem Lett 4: 371-2 (2013)


Article DOI: 10.1021/ml400055e
BindingDB Entry DOI: 10.7270/Q2B859FX
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50077924
PNG
(CHEMBL3417124)
Show SMILES COc1cc2CCC(N[C@@H]3CC[C@](C3)(C(C)C)C(=O)N3CCc4ccc(cc4C3)C(F)(F)F)c2cc1OC
Show InChI InChI=1S/C30H37F3N2O3/c1-18(2)29(28(36)35-12-10-19-5-7-22(30(31,32)33)13-21(19)17-35)11-9-23(16-29)34-25-8-6-20-14-26(37-3)27(38-4)15-24(20)25/h5,7,13-15,18,23,25,34H,6,8-12,16-17H2,1-4H3/t23-,25?,29+/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of 0.1 nM [125I]CCL2 from human CCR2 expressing human U2OS cell membrane by scintillation spectrometry


Eur J Med Chem 93: 121-34 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.063
BindingDB Entry DOI: 10.7270/Q25M67DX
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50416285
PNG
(CHEMBL1171008)
Show SMILES OC(=O)c1ccccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C18H11Cl3N2O5S/c19-10-7-15(23-29(26,27)11-5-6-13(20)14(21)8-11)17(22-9-10)28-16-4-2-1-3-12(16)18(24)25/h1-9,23H,(H,24,25)
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1.26n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human CCR2 expressed in CHO cells assessed as inhibition of MCP1-induced [35S]-GTPgammaS binding after 3 hrs


Bioorg Med Chem Lett 20: 3961-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.142
BindingDB Entry DOI: 10.7270/Q2B56KZ9
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506125
PNG
(CHEMBL4517518)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3cccc(Cl)c3)c(=O)n2n1
Show InChI InChI=1S/C15H14ClN5O/c16-10-3-1-2-8(6-10)7-11-12(9-4-5-9)18-15-19-14(17)20-21(15)13(11)22/h1-3,6,9H,4-5,7H2,(H3,17,18,19,20)
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1.30n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506125
PNG
(CHEMBL4517518)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3cccc(Cl)c3)c(=O)n2n1
Show InChI InChI=1S/C15H14ClN5O/c16-10-3-1-2-8(6-10)7-11-12(9-4-5-9)18-15-19-14(17)20-21(15)13(11)22/h1-3,6,9H,4-5,7H2,(H3,17,18,19,20)
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1.30n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506135
PNG
(CHEMBL4572833)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3ccc(Br)cc3)c(=O)n2n1
Show InChI InChI=1S/C15H14BrN5O/c16-10-5-1-8(2-6-10)7-11-12(9-3-4-9)18-15-19-14(17)20-21(15)13(11)22/h1-2,5-6,9H,3-4,7H2,(H3,17,18,19,20)
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1.40n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506135
PNG
(CHEMBL4572833)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3ccc(Br)cc3)c(=O)n2n1
Show InChI InChI=1S/C15H14BrN5O/c16-10-5-1-8(2-6-10)7-11-12(9-3-4-9)18-15-19-14(17)20-21(15)13(11)22/h1-2,5-6,9H,3-4,7H2,(H3,17,18,19,20)
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1.5n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506120
PNG
(CHEMBL4438407)
Show SMILES Nc1nc2[nH]c(C3CCCC3)c(Cc3cccc(Cl)c3)c(=O)n2n1
Show InChI InChI=1S/C17H18ClN5O/c18-12-7-3-4-10(8-12)9-13-14(11-5-1-2-6-11)20-17-21-16(19)22-23(17)15(13)24/h3-4,7-8,11H,1-2,5-6,9H2,(H3,19,20,21,22)
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1.5n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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1.5n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50416284
PNG
(CHEMBL1170828)
Show SMILES OC(=O)c1cccc(Oc2ncc(Cl)cc2NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C18H11Cl3N2O5S/c19-11-7-16(23-29(26,27)13-4-5-14(20)15(21)8-13)17(22-9-11)28-12-3-1-2-10(6-12)18(24)25/h1-9,23H,(H,24,25)
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1.58n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at human CCR2 expressed in CHO cells assessed as inhibition of MCP1-induced [35S]-GTPgammaS binding after 3 hrs


Bioorg Med Chem Lett 20: 3961-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.142
BindingDB Entry DOI: 10.7270/Q2B56KZ9
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506120
PNG
(CHEMBL4438407)
Show SMILES Nc1nc2[nH]c(C3CCCC3)c(Cc3cccc(Cl)c3)c(=O)n2n1
Show InChI InChI=1S/C17H18ClN5O/c18-12-7-3-4-10(8-12)9-13-14(11-5-1-2-6-11)20-17-21-16(19)22-23(17)15(13)24/h3-4,7-8,11H,1-2,5-6,9H2,(H3,19,20,21,22)
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1.60n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50077980
PNG
(CHEMBL3417117)
Show SMILES CC(C)[C@@]1(CC[C@H](C1)NC1CCc2cc(Cl)ccc12)C(=O)N1CCc2ccc(cc2C1)C(F)(F)F
Show InChI InChI=1S/C28H32ClF3N2O/c1-17(2)27(11-9-23(15-27)33-25-8-4-19-14-22(29)6-7-24(19)25)26(35)34-12-10-18-3-5-21(28(30,31)32)13-20(18)16-34/h3,5-7,13-14,17,23,25,33H,4,8-12,15-16H2,1-2H3/t23-,25?,27+/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of 0.1 nM [125I]CCL2 from human CCR2 expressing human U2OS cell membrane by scintillation spectrometry


Eur J Med Chem 93: 121-34 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.063
BindingDB Entry DOI: 10.7270/Q25M67DX
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506122
PNG
(CHEMBL4531005)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H15Cl2N5O/c1-7(2)12-9(6-8-4-3-5-10(16)11(8)17)13(23)22-15(19-12)20-14(18)21-22/h3-5,7H,6H2,1-2H3,(H3,18,19,20,21)
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1.60n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506115
PNG
(CHEMBL4463626)
Show SMILES Clc1cccc(Cc2c([nH]c3ncnn3c2=O)C2CC2)c1
Show InChI InChI=1S/C15H13ClN4O/c16-11-3-1-2-9(6-11)7-12-13(10-4-5-10)19-15-17-8-18-20(15)14(12)21/h1-3,6,8,10H,4-5,7H2,(H,17,18,19)
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1.70n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506115
PNG
(CHEMBL4463626)
Show SMILES Clc1cccc(Cc2c([nH]c3ncnn3c2=O)C2CC2)c1
Show InChI InChI=1S/C15H13ClN4O/c16-11-3-1-2-9(6-11)7-12-13(10-4-5-10)19-15-17-8-18-20(15)14(12)21/h1-3,6,8,10H,4-5,7H2,(H,17,18,19)
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1.70n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506116
PNG
(CHEMBL4548107)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3ccc(Cl)cc3)c(=O)n2n1
Show InChI InChI=1S/C15H14ClN5O/c16-10-5-1-8(2-6-10)7-11-12(9-3-4-9)18-15-19-14(17)20-21(15)13(11)22/h1-2,5-6,9H,3-4,7H2,(H3,17,18,19,20)
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1.80n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506116
PNG
(CHEMBL4548107)
Show SMILES Nc1nc2[nH]c(C3CC3)c(Cc3ccc(Cl)cc3)c(=O)n2n1
Show InChI InChI=1S/C15H14ClN5O/c16-10-5-1-8(2-6-10)7-11-12(9-3-4-9)18-15-19-14(17)20-21(15)13(11)22/h1-2,5-6,9H,3-4,7H2,(H3,17,18,19,20)
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1.80n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50506117
PNG
(CHEMBL4450273)
Show SMILES CC(C)c1[nH]c2nc(N)nn2c(=O)c1Cc1cccc(Cl)c1
Show InChI InChI=1S/C15H16ClN5O/c1-8(2)12-11(7-9-4-3-5-10(16)6-9)13(22)21-15(18-12)19-14(17)20-21/h3-6,8H,7H2,1-2H3,(H3,17,18,19,20)
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1.90n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CCR2-RA-[R] from human CCR2 expressed in human U2OS cells incubated for 2 hrs by scintillation spectrometric method


J Med Chem 62: 11035-11053 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00742
More data for this
Ligand-Target Pair
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