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Compile Data Set for Download or QSAR

Found 64 hits Enz. Inhib. hit(s) with all data for entry = 50038335   
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-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375120
PNG
(CHEMBL403040)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CC[C@@H]2CCCN2C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-22-13-11-20(12-14-22)27(39)19-38-26-10-2-9-25(33)29(26)37(31(38)34)18-15-23-7-4-17-36(23)30(40)24-8-1-5-21-6-3-16-35-28(21)24/h1-3,5-6,8-14,16,23,34H,4,7,15,17-19H2/t23-/m0/s1
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n/an/a 8n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375119
PNG
(CHEMBL401868)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CCCN(C2CC2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-22-12-10-20(11-13-22)27(39)19-38-26-9-2-8-25(33)29(26)37(31(38)34)18-4-17-36(23-14-15-23)30(40)24-7-1-5-21-6-3-16-35-28(21)24/h1-3,5-13,16,23,34H,4,14-15,17-19H2
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n/an/a 10n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375121
PNG
(CHEMBL257038)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375116
PNG
(CHEMBL403290)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375124
PNG
(CHEMBL256457)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C30H26Cl2N4O2/c1-34(29(38)23-11-10-20-6-2-3-7-22(20)18-23)16-5-17-35-28-25(32)8-4-9-26(28)36(30(35)33)19-27(37)21-12-14-24(31)15-13-21/h2-4,6-15,18,33H,5,16-17,19H2,1H3
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n/an/a 15n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375116
PNG
(CHEMBL403290)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375119
PNG
(CHEMBL401868)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CCCN(C2CC2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-22-12-10-20(11-13-22)27(39)19-38-26-9-2-8-25(33)29(26)37(31(38)34)18-4-17-36(23-14-15-23)30(40)24-7-1-5-21-6-3-16-35-28(21)24/h1-3,5-13,16,23,34H,4,14-15,17-19H2
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375117
PNG
(CHEMBL255798)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccn1
Show InChI InChI=1S/C25H23Cl2N5O2/c1-30(24(34)20-7-2-3-13-29-20)14-5-15-31-23-19(27)6-4-8-21(23)32(25(31)28)16-22(33)17-9-11-18(26)12-10-17/h2-4,6-13,28H,5,14-16H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375116
PNG
(CHEMBL403290)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375116
PNG
(CHEMBL403290)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375122
PNG
(CHEMBL427833)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1cccc2cccnc12
Show InChI InChI=1S/C29H25Cl2N5O2/c1-34(28(38)22-8-2-6-20-7-4-15-33-26(20)22)16-5-17-35-27-23(31)9-3-10-24(27)36(29(35)32)18-25(37)19-11-13-21(30)14-12-19/h2-4,6-15,32H,5,16-18H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375121
PNG
(CHEMBL257038)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375111
PNG
(CHEMBL409499)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccc1
Show InChI InChI=1S/C26H24Cl2N4O2/c1-30(25(34)19-7-3-2-4-8-19)15-6-16-31-24-21(28)9-5-10-22(24)32(26(31)29)17-23(33)18-11-13-20(27)14-12-18/h2-5,7-14,29H,6,15-17H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375123
PNG
(CHEMBL272558)
Show SMILES COc1ccccc1C(=O)N(C)CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C27H26Cl2N4O3/c1-31(26(35)20-7-3-4-10-24(20)36-2)15-6-16-32-25-21(29)8-5-9-22(25)33(27(32)30)17-23(34)18-11-13-19(28)14-12-18/h3-5,7-14,30H,6,15-17H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375120
PNG
(CHEMBL403040)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CC[C@@H]2CCCN2C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-22-13-11-20(12-14-22)27(39)19-38-26-10-2-9-25(33)29(26)37(31(38)34)18-15-23-7-4-17-36(23)30(40)24-8-1-5-21-6-3-16-35-28(21)24/h1-3,5-6,8-14,16,23,34H,4,7,15,17-19H2/t23-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375122
PNG
(CHEMBL427833)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1cccc2cccnc12
Show InChI InChI=1S/C29H25Cl2N5O2/c1-34(28(38)22-8-2-6-20-7-4-15-33-26(20)22)16-5-17-35-27-23(31)9-3-10-24(27)36(29(35)32)18-25(37)19-11-13-21(30)14-12-19/h2-4,6-15,32H,5,16-18H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375117
PNG
(CHEMBL255798)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccn1
Show InChI InChI=1S/C25H23Cl2N5O2/c1-30(24(34)20-7-2-3-13-29-20)14-5-15-31-23-19(27)6-4-8-21(23)32(25(31)28)16-22(33)17-9-11-18(26)12-10-17/h2-4,6-13,28H,5,14-16H2,1H3
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n/an/a 30n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50371837
PNG
(CHEMBL257663)
Show SMILES CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12
Show InChI InChI=1S/C18H18ClN3O/c1-3-12-5-4-6-15-17(12)21(2)18(20)22(15)11-16(23)13-7-9-14(19)10-8-13/h4-10,20H,3,11H2,1-2H3
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n/an/a 30n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375120
PNG
(CHEMBL403040)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CC[C@@H]2CCCN2C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-22-13-11-20(12-14-22)27(39)19-38-26-10-2-9-25(33)29(26)37(31(38)34)18-15-23-7-4-17-36(23)30(40)24-8-1-5-21-6-3-16-35-28(21)24/h1-3,5-6,8-14,16,23,34H,4,7,15,17-19H2/t23-/m0/s1
PDB

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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375124
PNG
(CHEMBL256457)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C30H26Cl2N4O2/c1-34(29(38)23-11-10-20-6-2-3-7-22(20)18-23)16-5-17-35-28-25(32)8-4-9-26(28)36(30(35)33)19-27(37)21-12-14-24(31)15-13-21/h2-4,6-15,18,33H,5,16-17,19H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375123
PNG
(CHEMBL272558)
Show SMILES COc1ccccc1C(=O)N(C)CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C27H26Cl2N4O3/c1-31(26(35)20-7-3-4-10-24(20)36-2)15-6-16-32-25-21(29)8-5-9-22(25)33(27(32)30)17-23(34)18-11-13-19(28)14-12-18/h3-5,7-14,30H,6,15-17H2,1-2H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375122
PNG
(CHEMBL427833)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1cccc2cccnc12
Show InChI InChI=1S/C29H25Cl2N5O2/c1-34(28(38)22-8-2-6-20-7-4-15-33-26(20)22)16-5-17-35-27-23(31)9-3-10-24(27)36(29(35)32)18-25(37)19-11-13-21(30)14-12-19/h2-4,6-15,32H,5,16-18H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375121
PNG
(CHEMBL257038)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m1/s1
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375126
PNG
(CHEMBL255583)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C27H26Cl2N4O2/c1-31(25(35)17-19-7-3-2-4-8-19)15-6-16-32-26-22(29)9-5-10-23(26)33(27(32)30)18-24(34)20-11-13-21(28)14-12-20/h2-5,7-14,30H,6,15-18H2,1H3
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n/an/a 70n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375116
PNG
(CHEMBL403290)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m0/s1
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375116
PNG
(CHEMBL403290)
Show SMILES Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
Show InChI InChI=1S/C31H27Cl2N5O2/c32-23-13-11-21(12-14-23)27(39)19-37-26-10-2-9-25(33)29(26)38(31(37)34)18-20-5-4-16-36(17-20)30(40)24-8-1-6-22-7-3-15-35-28(22)24/h1-3,6-15,20,34H,4-5,16-19H2/t20-/m0/s1
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375125
PNG
(CHEMBL256891)
Show SMILES CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(CCCN(C)C(=O)Cc3ccccc3)c12
Show InChI InChI=1S/C29H31ClN4O2/c1-3-22-11-7-12-25-28(22)33(18-8-17-32(2)27(36)19-21-9-5-4-6-10-21)29(31)34(25)20-26(35)23-13-15-24(30)16-14-23/h4-7,9-16,31H,3,8,17-20H2,1-2H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375123
PNG
(CHEMBL272558)
Show SMILES COc1ccccc1C(=O)N(C)CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C27H26Cl2N4O3/c1-31(26(35)20-7-3-4-10-24(20)36-2)15-6-16-32-25-21(29)8-5-9-22(25)33(27(32)30)17-23(34)18-11-13-19(28)14-12-18/h3-5,7-14,30H,6,15-17H2,1-2H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375117
PNG
(CHEMBL255798)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccn1
Show InChI InChI=1S/C25H23Cl2N5O2/c1-30(24(34)20-7-2-3-13-29-20)14-5-15-31-23-19(27)6-4-8-21(23)32(25(31)28)16-22(33)17-9-11-18(26)12-10-17/h2-4,6-13,28H,5,14-16H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375114
PNG
(CHEMBL411273)
Show SMILES CN(Cc1ccccc1)C(=O)CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C26H25ClN4O2/c1-29(17-19-7-3-2-4-8-19)25(33)15-16-30-22-9-5-6-10-23(22)31(26(30)28)18-24(32)20-11-13-21(27)14-12-20/h2-14,28H,15-18H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375125
PNG
(CHEMBL256891)
Show SMILES CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(CCCN(C)C(=O)Cc3ccccc3)c12
Show InChI InChI=1S/C29H31ClN4O2/c1-3-22-11-7-12-25-28(22)33(18-8-17-32(2)27(36)19-21-9-5-4-6-10-21)29(31)34(25)20-26(35)23-13-15-24(30)16-14-23/h4-7,9-16,31H,3,8,17-20H2,1-2H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375111
PNG
(CHEMBL409499)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccc1
Show InChI InChI=1S/C26H24Cl2N4O2/c1-30(25(34)19-7-3-2-4-8-19)15-6-16-31-24-21(28)9-5-10-22(24)32(26(31)29)17-23(33)18-11-13-20(27)14-12-18/h2-5,7-14,29H,6,15-17H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375126
PNG
(CHEMBL255583)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C27H26Cl2N4O2/c1-31(25(35)17-19-7-3-2-4-8-19)15-6-16-32-26-22(29)9-5-10-23(26)33(27(32)30)18-24(34)20-11-13-21(28)14-12-20/h2-5,7-14,30H,6,15-18H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375128
PNG
(CHEMBL271459)
Show SMILES CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccc1
Show InChI InChI=1S/C25H23ClN4O2/c1-28(24(32)19-7-3-2-4-8-19)15-16-29-21-9-5-6-10-22(21)30(25(29)27)17-23(31)18-11-13-20(26)14-12-18/h2-14,27H,15-17H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375127
PNG
(CHEMBL270166)
Show SMILES CN(CCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C26H24Cl2N4O2/c1-30(24(34)16-18-6-3-2-4-7-18)14-15-31-25-21(28)8-5-9-22(25)32(26(31)29)17-23(33)19-10-12-20(27)13-11-19/h2-13,29H,14-17H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375127
PNG
(CHEMBL270166)
Show SMILES CN(CCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C26H24Cl2N4O2/c1-30(24(34)16-18-6-3-2-4-7-18)14-15-31-25-21(28)8-5-9-22(25)32(26(31)29)17-23(33)19-10-12-20(27)13-11-19/h2-13,29H,14-17H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375118
PNG
(CHEMBL404517)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)C(C)(C)C
Show InChI InChI=1S/C24H28Cl2N4O2/c1-24(2,3)22(32)28(4)13-6-14-29-21-18(26)7-5-8-19(21)30(23(29)27)15-20(31)16-9-11-17(25)12-10-16/h5,7-12,27H,6,13-15H2,1-4H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375114
PNG
(CHEMBL411273)
Show SMILES CN(Cc1ccccc1)C(=O)CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C26H25ClN4O2/c1-29(17-19-7-3-2-4-8-19)25(33)15-16-30-22-9-5-6-10-23(22)31(26(30)28)18-24(32)20-11-13-21(27)14-12-20/h2-14,28H,15-18H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375113
PNG
(CHEMBL402855)
Show SMILES CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C26H25ClN4O2/c1-29(25(33)17-19-7-3-2-4-8-19)15-16-30-22-9-5-6-10-23(22)31(26(30)28)18-24(32)20-11-13-21(27)14-12-20/h2-14,28H,15-18H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375112
PNG
(CHEMBL257031)
Show SMILES CN(CCCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C28H28Cl2N4O2/c1-32(26(36)18-20-8-3-2-4-9-20)16-5-6-17-33-27-23(30)10-7-11-24(27)34(28(33)31)19-25(35)21-12-14-22(29)15-13-21/h2-4,7-15,31H,5-6,16-19H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375112
PNG
(CHEMBL257031)
Show SMILES CN(CCCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C28H28Cl2N4O2/c1-32(26(36)18-20-8-3-2-4-9-20)16-5-6-17-33-27-23(30)10-7-11-24(27)34(28(33)31)19-25(35)21-12-14-22(29)15-13-21/h2-4,7-15,31H,5-6,16-19H2,1H3
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n/an/a 400n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375124
PNG
(CHEMBL256457)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C30H26Cl2N4O2/c1-34(29(38)23-11-10-20-6-2-3-7-22(20)18-23)16-5-17-35-28-25(32)8-4-9-26(28)36(30(35)33)19-27(37)21-12-14-24(31)15-13-21/h2-4,6-15,18,33H,5,16-17,19H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375129
PNG
(CHEMBL270462)
Show SMILES CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)C1CCCCC1
Show InChI InChI=1S/C25H29ClN4O2/c1-28(24(32)19-7-3-2-4-8-19)15-16-29-21-9-5-6-10-22(21)30(25(29)27)17-23(31)18-11-13-20(26)14-12-18/h5-6,9-14,19,27H,2-4,7-8,15-17H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375118
PNG
(CHEMBL404517)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)C(C)(C)C
Show InChI InChI=1S/C24H28Cl2N4O2/c1-24(2,3)22(32)28(4)13-6-14-29-21-18(26)7-5-8-19(21)30(23(29)27)15-20(31)16-9-11-17(25)12-10-16/h5,7-12,27H,6,13-15H2,1-4H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375133
PNG
(CHEMBL440586 | cid_703050)
Show SMILES CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C17H16ClN3O/c1-2-20-14-5-3-4-6-15(14)21(17(20)19)11-16(22)12-7-9-13(18)10-8-12/h3-10,19H,2,11H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM94647
PNG
(1-(4-chlorophenyl)-2-(2-imino-3-methyl-1-benzimida...)
Show SMILES Cn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C16H14ClN3O/c1-19-13-4-2-3-5-14(13)20(16(19)18)10-15(21)11-6-8-12(17)9-7-11/h2-9,18H,10H2,1H3
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n/an/a 700n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM94647
PNG
(1-(4-chlorophenyl)-2-(2-imino-3-methyl-1-benzimida...)
Show SMILES Cn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Show InChI InChI=1S/C16H14ClN3O/c1-19-13-4-2-3-5-14(13)20(16(19)18)10-15(21)11-6-8-12(17)9-7-11/h2-9,18H,10H2,1H3
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n/an/a 700n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375113
PNG
(CHEMBL402855)
Show SMILES CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
Show InChI InChI=1S/C26H25ClN4O2/c1-29(25(33)17-19-7-3-2-4-8-19)15-16-30-22-9-5-6-10-23(22)31(26(30)28)18-24(32)20-11-13-21(27)14-12-20/h2-14,28H,15-18H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Mus musculus)
BDBM50375111
PNG
(CHEMBL409499)
Show SMILES CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccc1
Show InChI InChI=1S/C26H24Cl2N4O2/c1-30(25(34)19-7-3-2-4-8-19)15-6-16-31-24-21(28)9-5-10-22(24)32(26(31)29)17-23(33)18-11-13-20(27)14-12-18/h2-5,7-14,29H,6,15-17H2,1H3
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Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from mouse CXCR3 expressed in CHO cell membrane


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50375129
PNG
(CHEMBL270462)
Show SMILES CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)C1CCCCC1
Show InChI InChI=1S/C25H29ClN4O2/c1-28(24(32)19-7-3-2-4-8-19)15-16-29-21-9-5-6-10-22(21)30(25(29)27)17-23(31)18-11-13-20(26)14-12-18/h5-6,9-14,19,27H,2-4,7-8,15-17H2,1H3
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n/an/a 900n/an/an/an/an/an/a



Abbott Bioresearch Center

Curated by ChEMBL


Assay Description
Antagonist activity at human CXCR3 expressed in CHO cell membrane assessed as inhibition of calcium flux by FLIPR


Bioorg Med Chem Lett 18: 2414-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.049
BindingDB Entry DOI: 10.7270/Q2BP03NC
More data for this
Ligand-Target Pair
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