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PubMed code 26987013

Compile data set for download or QSAR
Found 96 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 9


(Homo sapiens (Human))		BDBM50398334
PNG
(CHEMBL2178578)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1cc[n+]([O-])cc1
Show InChI InChI=1S/C22H21ClN2O4S/c1-22(2,3)16-4-7-18(8-5-16)30(28,29)24-20-9-6-17(23)14-19(20)21(26)15-10-12-25(27)13-11-15/h4-14,24H,1-3H3
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 1.10n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393502
PNG
(US9969687, Compound 119)
Show SMILES COc1ccncc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-5-7-15(8-6-14)34(31,32)27-17-10-9-16(25)20-21(17)23(30)28(22(20)29)18-13-26-12-11-19(18)33-4/h5-13,27H,1-4H3
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 2n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393502
PNG
(US9969687, Compound 119)
Show SMILES COc1ccncc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-5-7-15(8-6-14)34(31,32)27-17-10-9-16(25)20-21(17)23(30)28(22(20)29)18-13-26-12-11-19(18)33-4/h5-13,27H,1-4H3
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 3n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393520
PNG
(US9969687, Compound 183)
Show SMILES COc1ncccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-7-9-15(10-8-14)34(31,32)27-17-12-11-16(25)19-20(17)23(30)28(22(19)29)18-6-5-13-26-21(18)33-4/h5-13,27H,1-4H3
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 3n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393520
PNG
(US9969687, Compound 183)
Show SMILES COc1ncccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-7-9-15(10-8-14)34(31,32)27-17-12-11-16(25)19-20(17)23(30)28(22(19)29)18-6-5-13-26-21(18)33-4/h5-13,27H,1-4H3
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 3n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393516
PNG
(US9969687, Compound 175)
Show SMILES Cc1ncccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-19(6-5-13-26-14)28-22(29)20-17(25)11-12-18(21(20)23(28)30)27-33(31,32)16-9-7-15(8-10-16)24(2,3)4/h5-13,27H,1-4H3
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 3n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50398334
PNG
(CHEMBL2178578)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1cc[n+]([O-])cc1
Show InChI InChI=1S/C22H21ClN2O4S/c1-22(2,3)16-4-7-18(8-5-16)30(28,29)24-20-9-6-17(23)14-19(20)21(26)15-10-12-25(27)13-11-15/h4-14,24H,1-3H3
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 3.70n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393530
PNG
(US9969687, Compound 194)
Show SMILES COc1c(ccc[n+]1[O-])N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O6S/c1-24(2,3)14-7-9-15(10-8-14)35(32,33)26-17-12-11-16(25)19-20(17)22(30)28(21(19)29)18-6-5-13-27(31)23(18)34-4/h5-13,26H,1-4H3
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 4n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393557
PNG
(US9969687, Compound 228)
Show SMILES Cc1cccc(n1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-6-5-7-19(26-14)28-22(29)20-17(25)12-13-18(21(20)23(28)30)27-33(31,32)16-10-8-15(9-11-16)24(2,3)4/h5-13,27H,1-4H3
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 5n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393553
PNG
(US9969687, Compound 224)
Show SMILES Cc1ccc(N2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c(C)n1
Show InChI InChI=1S/C25H24ClN3O4S/c1-14-6-13-20(15(2)27-14)29-23(30)21-18(26)11-12-19(22(21)24(29)31)28-34(32,33)17-9-7-16(8-10-17)25(3,4)5/h6-13,28H,1-5H3
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 5n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393517
PNG
(US9969687, Compound 176)
Show SMILES Cc1c(ccc[n+]1[O-])N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-14-19(6-5-13-27(14)31)28-22(29)20-17(25)11-12-18(21(20)23(28)30)26-34(32,33)16-9-7-15(8-10-16)24(2,3)4/h5-13,26H,1-4H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393553
PNG
(US9969687, Compound 224)
Show SMILES Cc1ccc(N2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c(C)n1
Show InChI InChI=1S/C25H24ClN3O4S/c1-14-6-13-20(15(2)27-14)29-23(30)21-18(26)11-12-19(22(21)24(29)31)28-34(32,33)17-9-7-16(8-10-17)25(3,4)5/h6-13,28H,1-5H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393557
PNG
(US9969687, Compound 228)
Show SMILES Cc1cccc(n1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-6-5-7-19(26-14)28-22(29)20-17(25)12-13-18(21(20)23(28)30)27-33(31,32)16-10-8-15(9-11-16)24(2,3)4/h5-13,27H,1-4H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393534
PNG
(US9969687, Compound 199)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cccc[n+]3[O-])C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)15-7-9-17(10-8-15)34(32,33)26-19-12-11-18(25)20-21(19)23(30)27(22(20)29)14-16-6-4-5-13-28(16)31/h4-13,26H,14H2,1-3H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393530
PNG
(US9969687, Compound 194)
Show SMILES COc1c(ccc[n+]1[O-])N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O6S/c1-24(2,3)14-7-9-15(10-8-14)35(32,33)26-17-12-11-16(25)19-20(17)22(30)28(21(19)29)18-6-5-13-27(31)23(18)34-4/h5-13,26H,1-4H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393552
PNG
(US9969687, Compound 222)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccccn1
Show InChI InChI=1S/C23H20ClN3O4S/c1-23(2,3)14-7-9-15(10-8-14)32(30,31)26-17-12-11-16(24)19-20(17)22(29)27(21(19)28)18-6-4-5-13-25-18/h4-13,26H,1-3H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393572
PNG
(US9969687, Compound 244)
Show SMILES Cc1cnccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-13-26-12-11-19(14)28-22(29)20-17(25)9-10-18(21(20)23(28)30)27-33(31,32)16-7-5-15(6-8-16)24(2,3)4/h5-13,27H,1-4H3
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 6n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393522
PNG
(US9969687, Compound 185)
Show SMILES Cc1ccncc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-11-12-26-13-19(14)28-22(29)20-17(25)9-10-18(21(20)23(28)30)27-33(31,32)16-7-5-15(6-8-16)24(2,3)4/h5-13,27H,1-4H3
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 7n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393549
PNG
(US9969687, Compound 218)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cccnc1F
Show InChI InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-6-8-14(9-7-13)33(31,32)27-16-11-10-15(24)18-19(16)22(30)28(21(18)29)17-5-4-12-26-20(17)25/h4-12,27H,1-3H3
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 7n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393536
PNG
(US9969687, Compound 201)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccncc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)16-4-6-17(7-5-16)33(31,32)27-19-9-8-18(25)20-21(19)23(30)28(22(20)29)14-15-10-12-26-13-11-15/h4-13,27H,14H2,1-3H3
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 8n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393559
PNG
(US9969687, Compound 230)
Show SMILES COc1ccc(N2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c(OC)n1
Show InChI InChI=1S/C25H24ClN3O6S/c1-25(2,3)14-6-8-15(9-7-14)36(32,33)28-17-11-10-16(26)20-21(17)24(31)29(23(20)30)18-12-13-19(34-4)27-22(18)35-5/h6-13,28H,1-5H3
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 8n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393552
PNG
(US9969687, Compound 222)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccccn1
Show InChI InChI=1S/C23H20ClN3O4S/c1-23(2,3)14-7-9-15(10-8-14)32(30,31)26-17-12-11-16(24)19-20(17)22(29)27(21(19)28)18-6-4-5-13-25-18/h4-13,26H,1-3H3
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 9n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393592
PNG
(US9969687, Compound 271)
Show SMILES CCOc1ccncc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-5-34-20-12-13-27-14-19(20)29-23(30)21-17(26)10-11-18(22(21)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-14,28H,5H2,1-4H3
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 9n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393550
PNG
(US9969687, Compound 219)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccc(F)cn1
Show InChI InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-4-7-15(8-5-13)33(31,32)27-17-10-9-16(24)19-20(17)22(30)28(21(19)29)18-11-6-14(25)12-26-18/h4-12,27H,1-3H3
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 10n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393534
PNG
(US9969687, Compound 199)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cccc[n+]3[O-])C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)15-7-9-17(10-8-15)34(32,33)26-19-12-11-18(25)20-21(19)23(30)27(22(20)29)14-16-6-4-5-13-28(16)31/h4-13,26H,14H2,1-3H3
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 10n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50398334
PNG
(CHEMBL2178578)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1cc[n+]([O-])cc1
Show InChI InChI=1S/C22H21ClN2O4S/c1-22(2,3)16-4-7-18(8-5-16)30(28,29)24-20-9-6-17(23)14-19(20)21(26)15-10-12-25(27)13-11-15/h4-14,24H,1-3H3
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 10n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393588
PNG
(US9969687, Compound 264)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccncc1
Show InChI InChI=1S/C23H20ClN3O4S/c1-23(2,3)14-4-6-16(7-5-14)32(30,31)26-18-9-8-17(24)19-20(18)22(29)27(21(19)28)15-10-12-25-13-11-15/h4-13,26H,1-3H3
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 11n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393587
PNG
(US9969687, Compound 263)
Show SMILES Cc1cnc(C)c(c1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O4S/c1-14-12-20(15(2)27-13-14)29-23(30)21-18(26)10-11-19(22(21)24(29)31)28-34(32,33)17-8-6-16(7-9-17)25(3,4)5/h6-13,28H,1-5H3
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 11n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393552
PNG
(US9969687, Compound 222)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccccn1
Show InChI InChI=1S/C23H20ClN3O4S/c1-23(2,3)14-7-9-15(10-8-14)32(30,31)26-17-12-11-16(24)19-20(17)22(29)27(21(19)28)18-6-4-5-13-25-18/h4-13,26H,1-3H3
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 12n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393516
PNG
(US9969687, Compound 175)
Show SMILES Cc1ncccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-19(6-5-13-26-14)28-22(29)20-17(25)11-12-18(21(20)23(28)30)27-33(31,32)16-9-7-15(8-10-16)24(2,3)4/h5-13,27H,1-4H3
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 12n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393545
PNG
(US9969687, Compound 213)
Show SMILES Cc1cc[n+]([O-])cc1CN1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-15-11-12-28(32)13-16(15)14-29-23(30)21-19(26)9-10-20(22(21)24(29)31)27-35(33,34)18-7-5-17(6-8-18)25(2,3)4/h5-13,27H,14H2,1-4H3
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 12n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393495
PNG
(US9969687, Compound 65)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccc[n+]([O-])c3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)16-6-8-17(9-7-16)34(32,33)26-19-11-10-18(25)20-21(19)23(30)28(22(20)29)14-15-5-4-12-27(31)13-15/h4-13,26H,14H2,1-3H3
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 13n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393583
PNG
(US9969687, Compound 259)
Show SMILES Cc1ccc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)[n+]([O-])c1
Show InChI InChI=1S/C25H24ClN3O5S/c1-15-5-8-17(29(32)13-15)14-28-23(30)21-19(26)11-12-20(22(21)24(28)31)27-35(33,34)18-9-6-16(7-10-18)25(2,3)4/h5-13,27H,14H2,1-4H3
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 13n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393568
PNG
(US9969687, Compound 239)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ncccc3F)C(=O)c12
Show InChI InChI=1S/C24H21ClFN3O4S/c1-24(2,3)14-6-8-15(9-7-14)34(32,33)28-18-11-10-16(25)20-21(18)23(31)29(22(20)30)13-19-17(26)5-4-12-27-19/h4-12,28H,13H2,1-3H3
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 13n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393517
PNG
(US9969687, Compound 176)
Show SMILES Cc1c(ccc[n+]1[O-])N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-14-19(6-5-13-27(14)31)28-22(29)20-17(25)11-12-18(21(20)23(28)30)26-34(32,33)16-9-7-15(8-10-16)24(2,3)4/h5-13,26H,1-4H3
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 13n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393567
PNG
(US9969687, Compound 238)
Show SMILES COc1ccc(N2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c(C)n1
Show InChI InChI=1S/C25H24ClN3O5S/c1-14-19(12-13-20(27-14)34-5)29-23(30)21-17(26)10-11-18(22(21)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-13,28H,1-5H3
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 14n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393516
PNG
(US9969687, Compound 175)
Show SMILES Cc1ncccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-19(6-5-13-26-14)28-22(29)20-17(25)11-12-18(21(20)23(28)30)27-33(31,32)16-9-7-15(8-10-16)24(2,3)4/h5-13,27H,1-4H3
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 14n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393584
PNG
(US9969687, Compound 260)
Show SMILES COc1ccc(nc1C)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-14-19(34-5)12-13-20(27-14)29-23(30)21-17(26)10-11-18(22(21)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-13,28H,1-5H3
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 16n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393491
PNG
(US9969687, Compound 44)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccc[n+]([O-])c1
Show InChI InChI=1S/C23H20ClN3O5S/c1-23(2,3)14-6-8-16(9-7-14)33(31,32)25-18-11-10-17(24)19-20(18)22(29)27(21(19)28)15-5-4-12-26(30)13-15/h4-13,25H,1-3H3
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 16n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393585
PNG
(US9969687, Compound 261)
Show SMILES COc1ncc(C)cc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-14-12-19(22(34-5)27-13-14)29-23(30)20-17(26)10-11-18(21(20)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-13,28H,1-5H3
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 16n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393536
PNG
(US9969687, Compound 201)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccncc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)16-4-6-17(7-5-16)33(31,32)27-19-9-8-18(25)20-21(19)23(30)28(22(20)29)14-15-10-12-26-13-11-15/h4-13,27H,14H2,1-3H3
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 17n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393580
PNG
(US9969687, Compound 256)
Show SMILES Cc1cnc(C#N)c(c1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H21ClN4O4S/c1-14-11-20(19(12-27)28-13-14)30-23(31)21-17(26)9-10-18(22(21)24(30)32)29-35(33,34)16-7-5-15(6-8-16)25(2,3)4/h5-11,13,29H,1-4H3
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 18n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393570
PNG
(US9969687, Compound 242)
Show SMILES COc1cncc(N2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c1C
Show InChI InChI=1S/C25H24ClN3O5S/c1-14-19(12-27-13-20(14)34-5)29-23(30)21-17(26)10-11-18(22(21)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-13,28H,1-5H3
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 18n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500887
PNG
(CHEMBL3800073)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1ccc(F)nc1
Show InChI InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-4-7-15(8-5-13)33(31,32)27-17-10-9-16(24)19-20(17)22(30)28(21(19)29)14-6-11-18(25)26-12-14/h4-12,27H,1-3H3
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 19n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393519
PNG
(US9969687, Compound 182)
Show SMILES Cc1ccc(cn1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-5-8-16(13-26-14)28-22(29)20-18(25)11-12-19(21(20)23(28)30)27-33(31,32)17-9-6-15(7-10-17)24(2,3)4/h5-13,27H,1-4H3
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 19n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393498
PNG
(US9969687, Compound 82)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(C#N)c2C(=O)N(Cc3cccnc3)C(=O)c12
Show InChI InChI=1S/C25H22N4O4S/c1-25(2,3)18-7-9-19(10-8-18)34(32,33)28-20-11-6-17(13-26)21-22(20)24(31)29(23(21)30)15-16-5-4-12-27-14-16/h4-12,14,28H,15H2,1-3H3
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 19n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393557
PNG
(US9969687, Compound 228)
Show SMILES Cc1cccc(n1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-6-5-7-19(26-14)28-22(29)20-17(25)12-13-18(21(20)23(28)30)27-33(31,32)16-10-8-15(9-11-16)24(2,3)4/h5-13,27H,1-4H3
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 19n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393527
PNG
(US9969687, Compound 191)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccccn3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)15-7-9-17(10-8-15)33(31,32)27-19-12-11-18(25)20-21(19)23(30)28(22(20)29)14-16-6-4-5-13-26-16/h4-13,27H,14H2,1-3H3
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 20n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393555
PNG
(US9969687, Compound 226)
Show SMILES Cc1ccc(nc1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-5-12-19(26-13-14)28-22(29)20-17(25)10-11-18(21(20)23(28)30)27-33(31,32)16-8-6-15(7-9-16)24(2,3)4/h5-13,27H,1-4H3
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 21n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393494
PNG
(US9969687, Compound 64)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cccnc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)16-6-8-17(9-7-16)33(31,32)27-19-11-10-18(25)20-21(19)23(30)28(22(20)29)14-15-5-4-12-26-13-15/h4-13,27H,14H2,1-3H3
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 22n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393596
PNG
(US9969687, Compound 276)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cc(F)ccn1
Show InChI InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-4-6-15(7-5-13)33(31,32)27-17-9-8-16(24)19-20(17)22(30)28(21(19)29)18-12-14(25)10-11-26-18/h4-12,27H,1-3H3
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 22n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393537
PNG
(US9969687, Compound 202)
Show SMILES COc1cccnc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-7-9-15(10-8-14)34(31,32)27-17-12-11-16(25)19-20(17)23(30)28(22(19)29)21-18(33-4)6-5-13-26-21/h5-13,27H,1-4H3
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 22n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393499
PNG
(US9969687, Compound 90)
Show SMILES COc1cncc(c1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-5-7-17(8-6-14)34(31,32)27-19-10-9-18(25)20-21(19)23(30)28(22(20)29)15-11-16(33-4)13-26-12-15/h5-13,27H,1-4H3
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 22n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393582
PNG
(US9969687, Compound 258)
Show SMILES Cc1cncc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c1
Show InChI InChI=1S/C25H24ClN3O4S/c1-15-11-16(13-27-12-15)14-29-23(30)21-19(26)9-10-20(22(21)24(29)31)28-34(32,33)18-7-5-17(6-8-18)25(2,3)4/h5-13,28H,14H2,1-4H3
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 23n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393517
PNG
(US9969687, Compound 176)
Show SMILES Cc1c(ccc[n+]1[O-])N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-14-19(6-5-13-27(14)31)28-22(29)20-17(25)11-12-18(21(20)23(28)30)26-34(32,33)16-9-7-15(8-10-16)24(2,3)4/h5-13,26H,1-4H3
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 24n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393541
PNG
(US9969687, Compound 208)
Show SMILES Cc1ccncc1CN1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O4S/c1-15-11-12-27-13-16(15)14-29-23(30)21-19(26)9-10-20(22(21)24(29)31)28-34(32,33)18-7-5-17(6-8-18)25(2,3)4/h5-13,28H,14H2,1-4H3
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 24n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393581
PNG
(US9969687, Compound 257)
Show SMILES CCc1c(OC)cncc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C26H26ClN3O5S/c1-6-17-20(13-28-14-21(17)35-5)30-24(31)22-18(27)11-12-19(23(22)25(30)32)29-36(33,34)16-9-7-15(8-10-16)26(2,3)4/h7-14,29H,6H2,1-5H3
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 25n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393490
PNG
(US9969687, Compound 43)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C23H20ClN3O4S/c1-23(2,3)14-6-8-16(9-7-14)32(30,31)26-18-11-10-17(24)19-20(18)22(29)27(21(19)28)15-5-4-12-25-13-15/h4-13,26H,1-3H3
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 25n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393549
PNG
(US9969687, Compound 218)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cccnc1F
Show InChI InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-6-8-14(9-7-13)33(31,32)27-16-11-10-15(24)18-19(16)22(30)28(21(18)29)17-5-4-12-26-20(17)25/h4-12,27H,1-3H3
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 26n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393494
PNG
(US9969687, Compound 64)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cccnc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)16-6-8-17(9-7-16)33(31,32)27-19-11-10-18(25)20-21(19)23(30)28(22(20)29)14-15-5-4-12-26-13-15/h4-13,27H,14H2,1-3H3
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 27n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393566
PNG
(US9969687, Compound 237)
Show SMILES COc1nccc(C)c1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-14-12-13-27-22(34-5)21(14)29-23(30)19-17(26)10-11-18(20(19)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-13,28H,1-5H3
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 28n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393542
PNG
(US9969687, Compound 209)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cc[n+]([O-])cc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)16-4-6-17(7-5-16)34(32,33)26-19-9-8-18(25)20-21(19)23(30)28(22(20)29)14-15-10-12-27(31)13-11-15/h4-13,26H,14H2,1-3H3
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 30n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393540
PNG
(US9969687, Compound 207)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cccc(n1)C#N
Show InChI InChI=1S/C24H19ClN4O4S/c1-24(2,3)14-7-9-16(10-8-14)34(32,33)28-18-12-11-17(25)20-21(18)23(31)29(22(20)30)19-6-4-5-15(13-26)27-19/h4-12,28H,1-3H3
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 30n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393501
PNG
(US9969687, Compound 104)
Show SMILES Cc1cncc(c1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-11-16(13-26-12-14)28-22(29)20-18(25)9-10-19(21(20)23(28)30)27-33(31,32)17-7-5-15(6-8-17)24(2,3)4/h5-13,27H,1-4H3
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 30n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393531
PNG
(US9969687, Compound 195)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cncc(c3)C#N)C(=O)c12
Show InChI InChI=1S/C25H21ClN4O4S/c1-25(2,3)17-4-6-18(7-5-17)35(33,34)29-20-9-8-19(26)21-22(20)24(32)30(23(21)31)14-16-10-15(11-27)12-28-13-16/h4-10,12-13,29H,14H2,1-3H3
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 31n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393520
PNG
(US9969687, Compound 183)
Show SMILES COc1ncccc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-7-9-15(10-8-14)34(31,32)27-17-12-11-16(25)19-20(17)23(30)28(22(19)29)18-6-5-13-26-21(18)33-4/h5-13,27H,1-4H3
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 32n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393502
PNG
(US9969687, Compound 119)
Show SMILES COc1ccncc1N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-5-7-15(8-6-14)34(31,32)27-17-10-9-16(25)20-21(17)23(30)28(22(20)29)18-13-26-12-11-19(18)33-4/h5-13,27H,1-4H3
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 35n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393495
PNG
(US9969687, Compound 65)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccc[n+]([O-])c3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)16-6-8-17(9-7-16)34(32,33)26-19-11-10-18(25)20-21(19)23(30)28(22(20)29)14-15-5-4-12-27(31)13-15/h4-13,26H,14H2,1-3H3
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 38n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393534
PNG
(US9969687, Compound 199)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cccc[n+]3[O-])C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)15-7-9-17(10-8-15)34(32,33)26-19-12-11-18(25)20-21(19)23(30)27(22(20)29)14-16-6-4-5-13-28(16)31/h4-13,26H,14H2,1-3H3
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 40n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393535
PNG
(US9969687, Compound 200)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cc(ccn1)C#N
Show InChI InChI=1S/C24H19ClN4O4S/c1-24(2,3)15-4-6-16(7-5-15)34(32,33)28-18-9-8-17(25)20-21(18)23(31)29(22(20)30)19-12-14(13-26)10-11-27-19/h4-12,28H,1-3H3
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 45n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393577
PNG
(US9969687, Compound 251)
Show SMILES Cc1ccc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)nc1
Show InChI InChI=1S/C25H24ClN3O4S/c1-15-5-8-17(27-13-15)14-29-23(30)21-19(26)11-12-20(22(21)24(29)31)28-34(32,33)18-9-6-16(7-10-18)25(2,3)4/h5-13,28H,14H2,1-4H3
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 51n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393554
PNG
(US9969687, Compound 225)
Show SMILES Cc1ccnc(c1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O4S/c1-14-11-12-26-19(13-14)28-22(29)20-17(25)9-10-18(21(20)23(28)30)27-33(31,32)16-7-5-15(6-8-16)24(2,3)4/h5-13,27H,1-4H3
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 54n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393578
PNG
(US9969687, Compound 254)
Show SMILES Cc1cccc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)n1
Show InChI InChI=1S/C25H24ClN3O4S/c1-15-6-5-7-17(27-15)14-29-23(30)21-19(26)12-13-20(22(21)24(29)31)28-34(32,33)18-10-8-16(9-11-18)25(2,3)4/h5-13,28H,14H2,1-4H3
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 58n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393544
PNG
(US9969687, Compound 212)
Show SMILES COc1cncc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c1
Show InChI InChI=1S/C25H24ClN3O5S/c1-25(2,3)16-5-7-18(8-6-16)35(32,33)28-20-10-9-19(26)21-22(20)24(31)29(23(21)30)14-15-11-17(34-4)13-27-12-15/h5-13,28H,14H2,1-4H3
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 59n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500881
PNG
(CHEMBL3800355)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cncc(c1)C#N
Show InChI InChI=1S/C24H19ClN4O4S/c1-24(2,3)15-4-6-17(7-5-15)34(32,33)28-19-9-8-18(25)20-21(19)23(31)29(22(20)30)16-10-14(11-26)12-27-13-16/h4-10,12-13,28H,1-3H3
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 73n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393495
PNG
(US9969687, Compound 65)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccc[n+]([O-])c3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)16-6-8-17(9-7-16)34(32,33)26-19-11-10-18(25)20-21(19)23(30)28(22(20)29)14-15-5-4-12-27(31)13-15/h4-13,26H,14H2,1-3H3
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 74n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9A receptor (unknown origin) overexpressed in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intrace...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393574
PNG
(US9969687, Compound 247)
Show SMILES COc1ncccc1CN1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-25(2,3)16-7-9-17(10-8-16)35(32,33)28-19-12-11-18(26)20-21(19)24(31)29(23(20)30)14-15-6-5-13-27-22(15)34-4/h5-13,28H,14H2,1-4H3
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 78n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500888
PNG
(CHEMBL3797948)
Show SMILES COc1ccc(cn1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O5S/c1-24(2,3)14-5-8-16(9-6-14)34(31,32)27-18-11-10-17(25)20-21(18)23(30)28(22(20)29)15-7-12-19(33-4)26-13-15/h5-13,27H,1-4H3
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 78n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500891
PNG
(CHEMBL3799395)
Show SMILES Cc1ccc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)cn1
Show InChI InChI=1S/C25H24ClN3O4S/c1-15-5-6-16(13-27-15)14-29-23(30)21-19(26)11-12-20(22(21)24(29)31)28-34(32,33)18-9-7-17(8-10-18)25(2,3)4/h5-13,28H,14H2,1-4H3
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 85n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393549
PNG
(US9969687, Compound 218)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(C(=O)c12)c1cccnc1F
Show InChI InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-6-8-14(9-7-13)33(31,32)27-16-11-10-15(24)18-19(16)22(30)28(21(18)29)17-5-4-12-26-20(17)25/h4-12,27H,1-3H3
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 91n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393536
PNG
(US9969687, Compound 201)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3ccncc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)16-4-6-17(7-5-16)33(31,32)27-19-9-8-18(25)20-21(19)23(30)28(22(20)29)14-15-10-12-26-13-11-15/h4-13,27H,14H2,1-3H3
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>100n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500883
PNG
(CHEMBL3800351)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(CCc3cccnc3)C(=O)c12
Show InChI InChI=1S/C25H24ClN3O4S/c1-25(2,3)17-6-8-18(9-7-17)34(32,33)28-20-11-10-19(26)21-22(20)24(31)29(23(21)30)14-12-16-5-4-13-27-15-16/h4-11,13,15,28H,12,14H2,1-3H3
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 100n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500892
PNG
(CHEMBL3800612)
Show SMILES COc1cc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)ccn1
Show InChI InChI=1S/C25H24ClN3O5S/c1-25(2,3)16-5-7-17(8-6-16)35(32,33)28-19-10-9-18(26)21-22(19)24(31)29(23(21)30)14-15-11-12-27-20(13-15)34-4/h5-13,28H,14H2,1-4H3
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 108n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393530
PNG
(US9969687, Compound 194)
Show SMILES COc1c(ccc[n+]1[O-])N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C24H22ClN3O6S/c1-24(2,3)14-7-9-15(10-8-14)35(32,33)26-17-12-11-16(25)19-20(17)22(30)28(21(19)29)18-6-5-13-27(31)23(18)34-4/h5-13,26H,1-4H3
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 113n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393564
PNG
(US9969687, Compound 235)
Show SMILES COc1ccc(CN2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)cn1
Show InChI InChI=1S/C25H24ClN3O5S/c1-25(2,3)16-6-8-17(9-7-16)35(32,33)28-19-11-10-18(26)21-22(19)24(31)29(23(21)30)14-15-5-12-20(34-4)27-13-15/h5-13,28H,14H2,1-4H3
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 123n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500882
PNG
(CHEMBL3799583)
Show SMILES FC(F)(F)Oc1ccc(cc1)S(=O)(=O)Nc1cccc2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C20H12F3N3O5S/c21-20(22,23)31-13-6-8-14(9-7-13)32(29,30)25-16-5-1-4-15-17(16)19(28)26(18(15)27)12-3-2-10-24-11-12/h1-11,25H
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 123n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393500
PNG
(US9969687, Compound 103)
Show SMILES CCOc1cncc(c1)N1C(=O)c2c(C1=O)c(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)ccc2Cl
Show InChI InChI=1S/C25H24ClN3O5S/c1-5-34-17-12-16(13-27-14-17)29-23(30)21-19(26)10-11-20(22(21)24(29)31)28-35(32,33)18-8-6-15(7-9-18)25(2,3)4/h6-14,28H,5H2,1-4H3
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 128n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500889
PNG
(CHEMBL3799957)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C24H23N3O4S/c1-15-7-12-19(26-32(30,31)18-10-8-16(9-11-18)24(2,3)4)21-20(15)22(28)27(23(21)29)17-6-5-13-25-14-17/h5-14,26H,1-4H3
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 189n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500890
PNG
(CHEMBL3797668)
Show SMILES FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)Nc1cccc2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C20H11ClF3N3O4S/c21-15-7-6-12(9-14(15)20(22,23)24)32(30,31)26-16-5-1-4-13-17(16)19(29)27(18(13)28)11-3-2-8-25-10-11/h1-10,26H
PDB

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 206n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393553
PNG
(US9969687, Compound 224)
Show SMILES Cc1ccc(N2C(=O)c3c(C2=O)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)ccc3Cl)c(C)n1
Show InChI InChI=1S/C25H24ClN3O4S/c1-14-6-13-20(15(2)27-14)29-23(30)21-18(26)11-12-19(22(21)24(29)31)28-34(32,33)17-9-7-16(8-10-17)25(3,4)5/h6-13,28H,1-5H3
PDB

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>300n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393494
PNG
(US9969687, Compound 64)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)c2C(=O)N(Cc3cccnc3)C(=O)c12
Show InChI InChI=1S/C24H22ClN3O4S/c1-24(2,3)16-6-8-17(9-7-16)33(31,32)27-19-11-10-18(25)20-21(19)23(30)28(22(20)29)14-15-5-4-12-26-13-15/h4-13,27H,14H2,1-3H3
PDB

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 357n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCl25-mediated cell migration preincubated for 30 mins followed C...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393515
PNG
(US9969687, Compound 160)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c2C(=O)N(Cc3cccnc3)C(=O)c12
Show InChI InChI=1S/C25H25N3O4S/c1-16-7-12-20(27-33(31,32)19-10-8-18(9-11-19)25(2,3)4)22-21(16)23(29)28(24(22)30)15-17-6-5-13-26-14-17/h5-14,27H,15H2,1-4H3
PDB

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 456n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM393488
PNG
(US9969687, Compound 1)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1cccc2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C23H21N3O4S/c1-23(2,3)15-9-11-17(12-10-15)31(29,30)25-19-8-4-7-18-20(19)22(28)26(21(18)27)16-6-5-13-24-14-16/h4-14,25H,1-3H3
PDB

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 479n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500884
PNG
(CHEMBL3797407)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1cccc2C(=O)N(Cc3cccnc3)C(=O)c12
Show InChI InChI=1S/C24H23N3O4S/c1-24(2,3)17-9-11-18(12-10-17)32(30,31)26-20-8-4-7-19-21(20)23(29)27(22(19)28)15-16-6-5-13-25-14-16/h4-14,26H,15H2,1-3H3
PDB

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 618n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500885
PNG
(CHEMBL3798585)
Show SMILES Fc1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1cccc2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C20H11F4N3O4S/c21-15-7-6-12(9-14(15)20(22,23)24)32(30,31)26-16-5-1-4-13-17(16)19(29)27(18(13)28)11-3-2-8-25-10-11/h1-10,26H
PDB

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 1.32E+3n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 9


(Homo sapiens (Human))		BDBM50500886
PNG
(CHEMBL3797343)
Show SMILES FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1cccc2C(=O)N(C(=O)c12)c1cccnc1
Show InChI InChI=1S/C20H12F3N3O4S/c21-20(22,23)12-4-1-6-14(10-12)31(29,30)25-16-8-2-7-15-17(16)19(28)26(18(15)27)13-5-3-9-24-11-13/h1-11,25H
PDB

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 2.71E+3n/an/an/an/an/an/an/an/a



Norgine Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at CCR9 receptor in human MOLT4 cells assessed as inhibition of CCL25-induced increase in intracellular calcium level preincubate...

J Med Chem 59: 3098-111 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01840
BindingDB Entry DOI: 10.7270/Q28918WJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%