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PubMed code 22003428

Compile data set for download or QSAR
Found 136 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
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62288
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-(tr...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H21F3N2O2/c25-24(26,27)31-22-11-9-21(10-12-22)28-23(30)19-7-5-17(6-8-19)15-29-14-13-18-3-1-2-4-20(18)16-29/h1-12H,13-16H2,(H,28,30)
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n/an/a 30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62288
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-(tr...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H21F3N2O2/c25-24(26,27)31-22-11-9-21(10-12-22)28-23(30)19-7-5-17(6-8-19)15-29-14-13-18-3-1-2-4-20(18)16-29/h1-12H,13-16H2,(H,28,30)
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n/an/a 80n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62170
PNG
(1-(4-chlorophenyl)sulfonyl-2-benzimidazolamine | 1...)
Show SMILES Nc1nc2ccccc2n1S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H10ClN3O2S/c14-9-5-7-10(8-6-9)20(18,19)17-12-4-2-1-3-11(12)16-13(17)15/h1-8H,(H2,15,16)
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n/an/a 90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM54409
PNG
(4-[4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-benzo...)
Show SMILES CCOC(=O)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C26H26N2O3/c1-2-31-26(30)22-11-13-24(14-12-22)27-25(29)21-9-7-19(8-10-21)17-28-16-15-20-5-3-4-6-23(20)18-28/h3-14H,2,15-18H2,1H3,(H,27,29)
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n/an/a 150n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62251
PNG
(MLS-0412140.0001 | cid_44182145 | cyclopropyl-[2-m...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C23H26N4O5S/c1-16-14-18-15-21(8-9-22(18)26(16)23(28)17-2-3-17)33(31,32)25-12-10-24(11-13-25)19-4-6-20(7-5-19)27(29)30/h4-9,15-17H,2-3,10-14H2,1H3
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n/an/a 200n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62261
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-met...)
Show SMILES CSc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H24N2OS/c1-28-23-12-10-22(11-13-23)25-24(27)20-8-6-18(7-9-20)16-26-15-14-19-4-2-3-5-21(19)17-26/h2-13H,14-17H2,1H3,(H,25,27)
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n/an/a 240n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62251
PNG
(MLS-0412140.0001 | cid_44182145 | cyclopropyl-[2-m...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C23H26N4O5S/c1-16-14-18-15-21(8-9-22(18)26(16)23(28)17-2-3-17)33(31,32)25-12-10-24(11-13-25)19-4-6-20(7-5-19)27(29)30/h4-9,15-17H,2-3,10-14H2,1H3
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n/an/a 260n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62261
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-met...)
Show SMILES CSc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H24N2OS/c1-28-23-12-10-22(11-13-23)25-24(27)20-8-6-18(7-9-20)16-26-15-14-19-4-2-3-5-21(19)17-26/h2-13H,14-17H2,1H3,(H,25,27)
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n/an/a 260n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62257
PNG
(MLS-0360553.0001 | cid_20901691 | cyclopropyl-[5-[...)
Show SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(C(C)Cc2c1)C(=O)C1CC1
Show InChI InChI=1S/C24H29N3O4S/c1-17-15-19-16-22(9-10-23(19)27(17)24(28)18-3-4-18)32(29,30)26-13-11-25(12-14-26)20-5-7-21(31-2)8-6-20/h5-10,16-18H,3-4,11-15H2,1-2H3
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n/an/a 390n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM54409
PNG
(4-[4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-benzo...)
Show SMILES CCOC(=O)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C26H26N2O3/c1-2-31-26(30)22-11-13-24(14-12-22)27-25(29)21-9-7-19(8-10-21)17-28-16-15-20-5-3-4-6-23(20)18-28/h3-14H,2,15-18H2,1H3,(H,27,29)
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n/an/a 400n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62257
PNG
(MLS-0360553.0001 | cid_20901691 | cyclopropyl-[5-[...)
Show SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(C(C)Cc2c1)C(=O)C1CC1
Show InChI InChI=1S/C24H29N3O4S/c1-17-15-19-16-22(9-10-23(19)27(17)24(28)18-3-4-18)32(29,30)26-13-11-25(12-14-26)20-5-7-21(31-2)8-6-20/h5-10,16-18H,3-4,11-15H2,1-2H3
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n/an/a 510n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62295
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-met...)
Show SMILES COc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H24N2O2/c1-28-23-12-10-22(11-13-23)25-24(27)20-8-6-18(7-9-20)16-26-15-14-19-4-2-3-5-21(19)17-26/h2-13H,14-17H2,1H3,(H,25,27)
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n/an/a 510n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM59542
PNG
((1-tosylbenzimidazol-2-yl)amine | 1-(4-methylpheny...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C14H13N3O2S/c1-10-6-8-11(9-7-10)20(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)
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n/an/a 560n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM59544
PNG
(4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-eth...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C25H26N2O2/c1-2-29-24-13-11-23(12-14-24)26-25(28)21-9-7-19(8-10-21)17-27-16-15-20-5-3-4-6-22(20)18-27/h3-14H,2,15-18H2,1H3,(H,26,28)
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n/an/a 570n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62249
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2-...)
Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H26ClN3O3S/c1-3-22(27)26-16(2)14-17-15-20(8-9-21(17)26)30(28,29)25-12-10-24(11-13-25)19-6-4-18(23)5-7-19/h4-9,15-16H,3,10-14H2,1-2H3
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n/an/a 600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62295
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-met...)
Show SMILES COc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H24N2O2/c1-28-23-12-10-22(11-13-23)25-24(27)20-8-6-18(7-9-20)16-26-15-14-19-4-2-3-5-21(19)17-26/h2-13H,14-17H2,1H3,(H,25,27)
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n/an/a 780n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM54413
PNG
(CHEMBL1612423 | MLS001202690 | N-(4-Chloro-phenyl)...)
Show SMILES Clc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H21ClN2O/c24-21-9-11-22(12-10-21)25-23(27)19-7-5-17(6-8-19)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a 830n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62249
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2-...)
Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H26ClN3O3S/c1-3-22(27)26-16(2)14-17-15-20(8-9-21(17)26)30(28,29)25-12-10-24(11-13-25)19-6-4-18(23)5-7-19/h4-9,15-16H,3,10-14H2,1-2H3
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n/an/a 1.01E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62302
PNG
(MLS-0425608.0001 | N-(4-bromophenyl)-4-(3,4-dihydr...)
Show SMILES Brc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H21BrN2O/c24-21-9-11-22(12-10-21)25-23(27)19-7-5-17(6-8-19)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a 1.03E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM59544
PNG
(4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-eth...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C25H26N2O2/c1-2-29-24-13-11-23(12-14-24)26-25(28)21-9-7-19(8-10-21)17-27-16-15-20-5-3-4-6-22(20)18-27/h3-14H,2,15-18H2,1H3,(H,26,28)
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n/an/a 1.13E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62245
PNG
(1-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]sul...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C21H24N4O5S/c1-15-13-17-14-20(7-8-21(17)24(15)16(2)26)31(29,30)23-11-9-22(10-12-23)18-3-5-19(6-4-18)25(27)28/h3-8,14-15H,9-13H2,1-2H3
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n/an/a 1.41E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM54470
PNG
(1-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]sul...)
Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C22H26N4O5S/c1-3-22(27)25-16(2)14-17-15-20(8-9-21(17)25)32(30,31)24-12-10-23(11-13-24)18-4-6-19(7-5-18)26(28)29/h4-9,15-16H,3,10-14H2,1-2H3
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n/an/a 1.55E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62250
PNG
(1-[5-[4-(4-acetylphenyl)piperazin-1-yl]sulfonyl-2-...)
Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C24H29N3O4S/c1-4-24(29)27-17(2)15-20-16-22(9-10-23(20)27)32(30,31)26-13-11-25(12-14-26)21-7-5-19(6-8-21)18(3)28/h5-10,16-17H,4,11-15H2,1-3H3
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n/an/a 1.58E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62286
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-(di...)
Show SMILES CN(C)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C25H27N3O/c1-27(2)24-13-11-23(12-14-24)26-25(29)21-9-7-19(8-10-21)17-28-16-15-20-5-3-4-6-22(20)18-28/h3-14H,15-18H2,1-2H3,(H,26,29)
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n/an/a 1.61E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62302
PNG
(MLS-0425608.0001 | N-(4-bromophenyl)-4-(3,4-dihydr...)
Show SMILES Brc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H21BrN2O/c24-21-9-11-22(12-10-21)25-23(27)19-7-5-17(6-8-19)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a 1.62E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62245
PNG
(1-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]sul...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C21H24N4O5S/c1-15-13-17-14-20(7-8-21(17)24(15)16(2)26)31(29,30)23-11-9-22(10-12-23)18-3-5-19(6-4-18)25(27)28/h3-8,14-15H,9-13H2,1-2H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62246
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2-...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H24ClN3O3S/c1-15-13-17-14-20(7-8-21(17)25(15)16(2)26)29(27,28)24-11-9-23(10-12-24)19-5-3-18(22)4-6-19/h3-8,14-15H,9-13H2,1-2H3
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n/an/a 1.75E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62240
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-flu...)
Show SMILES Fc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H21FN2O/c24-21-9-11-22(12-10-21)25-23(27)19-7-5-17(6-8-19)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a 1.85E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM54470
PNG
(1-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]sul...)
Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C22H26N4O5S/c1-3-22(27)25-16(2)14-17-15-20(8-9-21(17)25)32(30,31)24-12-10-23(11-13-24)18-4-6-19(7-5-18)26(28)29/h4-9,15-16H,3,10-14H2,1-2H3
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n/an/a 1.87E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62250
PNG
(1-[5-[4-(4-acetylphenyl)piperazin-1-yl]sulfonyl-2-...)
Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C24H29N3O4S/c1-4-24(29)27-17(2)15-20-16-22(9-10-23(20)27)32(30,31)26-13-11-25(12-14-26)21-7-5-19(6-8-21)18(3)28/h5-10,16-17H,4,11-15H2,1-3H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62171
PNG
((1-besylbenzimidazol-2-yl)amine | 1-(benzenesulfon...)
Show SMILES Nc1nc2ccccc2n1S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H11N3O2S/c14-13-15-11-8-4-5-9-12(11)16(13)19(17,18)10-6-2-1-3-7-10/h1-9H,(H2,14,15)
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n/an/a 2.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62246
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2-...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H24ClN3O3S/c1-15-13-17-14-20(7-8-21(17)25(15)16(2)26)29(27,28)24-11-9-23(10-12-24)19-5-3-18(22)4-6-19/h3-8,14-15H,9-13H2,1-2H3
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n/an/a 2.57E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62172
PNG
(1-(4-methoxyphenyl)sulfonyl-2-benzimidazolamine | ...)
Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C14H13N3O3S/c1-20-10-6-8-11(9-7-10)21(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)
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n/an/a 2.70E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62303
PNG
((2-amino-1-benzimidazolyl)-(2,4-dichlorophenyl)met...)
Show SMILES Nc1nc2ccccc2n1C(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C14H9Cl2N3O/c15-8-5-6-9(10(16)7-8)13(20)19-12-4-2-1-3-11(12)18-14(19)17/h1-7H,(H2,17,18)
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n/an/a 2.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62240
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-flu...)
Show SMILES Fc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H21FN2O/c24-21-9-11-22(12-10-21)25-23(27)19-7-5-17(6-8-19)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a 3.11E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62254
PNG
(1-[5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-2...)
Show SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(C(C)Cc2c1)C(C)=O
Show InChI InChI=1S/C22H27N3O4S/c1-16-14-18-15-21(8-9-22(18)25(16)17(2)26)30(27,28)24-12-10-23(11-13-24)19-4-6-20(29-3)7-5-19/h4-9,15-16H,10-14H2,1-3H3
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n/an/a 3.29E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62335
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-met...)
Show SMILES Cc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H24N2O/c1-18-6-12-23(13-7-18)25-24(27)21-10-8-19(9-11-21)16-26-15-14-20-4-2-3-5-22(20)17-26/h2-13H,14-17H2,1H3,(H,25,27)
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n/an/a 3.44E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62253
PNG
(1-[2-methyl-5-[4-(4-methylphenyl)piperazin-1-yl]su...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(C)cc1
Show InChI InChI=1S/C22H27N3O3S/c1-16-4-6-20(7-5-16)23-10-12-24(13-11-23)29(27,28)21-8-9-22-19(15-21)14-17(2)25(22)18(3)26/h4-9,15,17H,10-14H2,1-3H3
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n/an/a 3.45E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM54413
PNG
(CHEMBL1612423 | MLS001202690 | N-(4-Chloro-phenyl)...)
Show SMILES Clc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H21ClN2O/c24-21-9-11-22(12-10-21)25-23(27)19-7-5-17(6-8-19)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a 3.54E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62286
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[4-(di...)
Show SMILES CN(C)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C25H27N3O/c1-27(2)24-13-11-23(12-14-24)26-25(29)21-9-7-19(8-10-21)17-28-16-15-20-5-3-4-6-22(20)18-28/h3-14H,15-18H2,1-2H3,(H,26,29)
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n/an/a 3.58E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62254
PNG
(1-[5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-2...)
Show SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(C(C)Cc2c1)C(C)=O
Show InChI InChI=1S/C22H27N3O4S/c1-16-14-18-15-21(8-9-22(18)25(16)17(2)26)30(27,28)24-12-10-23(11-13-24)19-4-6-20(29-3)7-5-19/h4-9,15-16H,10-14H2,1-3H3
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n/an/a 3.63E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM54502
PNG
(CHEMBL1351584 | MLS001122908 | SMR000628306 | [5-[...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H26ClN3O3S/c1-16-14-18-15-21(8-9-22(18)27(16)23(28)17-2-3-17)31(29,30)26-12-10-25(11-13-26)20-6-4-19(24)5-7-20/h4-9,15-17H,2-3,10-14H2,1H3
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n/an/a 3.63E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62247
PNG
(1-[4-[4-(1-acetyl-2-methyl-indolin-5-yl)sulfonylpi...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C23H27N3O4S/c1-16-14-20-15-22(8-9-23(20)26(16)18(3)28)31(29,30)25-12-10-24(11-13-25)21-6-4-19(5-7-21)17(2)27/h4-9,15-16H,10-14H2,1-3H3
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n/an/a 3.72E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62303
PNG
((2-amino-1-benzimidazolyl)-(2,4-dichlorophenyl)met...)
Show SMILES Nc1nc2ccccc2n1C(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C14H9Cl2N3O/c15-8-5-6-9(10(16)7-8)13(20)19-12-4-2-1-3-11(12)18-14(19)17/h1-7H,(H2,17,18)
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n/an/a 3.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62247
PNG
(1-[4-[4-(1-acetyl-2-methyl-indolin-5-yl)sulfonylpi...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C23H27N3O4S/c1-16-14-20-15-22(8-9-23(20)26(16)18(3)28)31(29,30)25-12-10-24(11-13-25)21-6-4-19(5-7-21)17(2)27/h4-9,15-16H,10-14H2,1-3H3
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n/an/a 4.42E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM54502
PNG
(CHEMBL1351584 | MLS001122908 | SMR000628306 | [5-[...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H26ClN3O3S/c1-16-14-18-15-21(8-9-22(18)27(16)23(28)17-2-3-17)31(29,30)26-12-10-25(11-13-26)20-6-4-19(24)5-7-20/h4-9,15-17H,2-3,10-14H2,1H3
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n/an/a 5.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62253
PNG
(1-[2-methyl-5-[4-(4-methylphenyl)piperazin-1-yl]su...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccc(C)cc1
Show InChI InChI=1S/C22H27N3O3S/c1-16-4-6-20(7-5-16)23-10-12-24(13-11-23)29(27,28)21-8-9-22-19(15-21)14-17(2)25(22)18(3)26/h4-9,15,17H,10-14H2,1-3H3
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n/an/a 5.76E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62324
PNG
(4-[4-(1-acetylindolin-5-yl)sulfonylpiperazino]benz...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C21H22N4O3S/c1-16(26)25-9-8-18-14-20(6-7-21(18)25)29(27,28)24-12-10-23(11-13-24)19-4-2-17(15-22)3-5-19/h2-7,14H,8-13H2,1H3
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n/an/a 5.87E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62169
PNG
(1-(4-methylphenyl)sulfonylbenzimidazole | 1-tosylb...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cnc2ccccc12
Show InChI InChI=1S/C14H12N2O2S/c1-11-6-8-12(9-7-11)19(17,18)16-10-15-13-4-2-3-5-14(13)16/h2-10H,1H3
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n/an/a 6.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62318
PNG
(MLS-0425662.0001 | cid_44251468 | cyclopropyl-[5-[...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1
Show InChI InChI=1S/C22H24N4O5S/c27-22(16-1-2-16)25-10-9-17-15-20(7-8-21(17)25)32(30,31)24-13-11-23(12-14-24)18-3-5-19(6-4-18)26(28)29/h3-8,15-16H,1-2,9-14H2
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n/an/a 6.50E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62334
PNG
(1-[(4-chlorophenyl)methyl]-2-benzimidazolamine | 1...)
Show SMILES Nc1nc2ccccc2n1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C14H12ClN3/c15-11-7-5-10(6-8-11)9-18-13-4-2-1-3-12(13)17-14(18)16/h1-8H,9H2,(H2,16,17)
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n/an/a 7.70E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62248
PNG
(1-[4-[4-[(1-cyclopropylcarbonyl-2-methyl-2,3-dihyd...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C25H29N3O4S/c1-17-15-21-16-23(9-10-24(21)28(17)25(30)20-3-4-20)33(31,32)27-13-11-26(12-14-27)22-7-5-19(6-8-22)18(2)29/h5-10,16-17,20H,3-4,11-15H2,1-2H3
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n/an/a 7.90E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62252
PNG
(1-[2-methyl-5-(4-phenylpiperazin-1-yl)sulfonyl-2,3...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16-14-18-15-20(8-9-21(18)24(16)17(2)25)28(26,27)23-12-10-22(11-13-23)19-6-4-3-5-7-19/h3-9,15-16H,10-14H2,1-2H3
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n/an/a 8.27E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62318
PNG
(MLS-0425662.0001 | cid_44251468 | cyclopropyl-[5-[...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1
Show InChI InChI=1S/C22H24N4O5S/c27-22(16-1-2-16)25-10-9-17-15-20(7-8-21(17)25)32(30,31)24-13-11-23(12-14-24)18-3-5-19(6-4-18)26(28)29/h3-8,15-16H,1-2,9-14H2
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n/an/a 8.45E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62324
PNG
(4-[4-(1-acetylindolin-5-yl)sulfonylpiperazino]benz...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C21H22N4O3S/c1-16(26)25-9-8-18-14-20(6-7-21(18)25)29(27,28)24-12-10-23(11-13-24)19-4-2-17(15-22)3-5-19/h2-7,14H,8-13H2,1H3
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n/an/a 9.24E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62248
PNG
(1-[4-[4-[(1-cyclopropylcarbonyl-2-methyl-2,3-dihyd...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C25H29N3O4S/c1-17-15-21-16-23(9-10-24(21)28(17)25(30)20-3-4-20)33(31,32)27-13-11-26(12-14-27)22-7-5-19(6-8-22)18(2)29/h5-10,16-17,20H,3-4,11-15H2,1-2H3
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n/an/a 1.03E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62290
PNG
(4-[[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]be...)
Show SMILES CCOC(=O)c1ccc(NC(=O)c2ccc(CCN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C27H28N2O3/c1-2-32-27(31)23-11-13-25(14-12-23)28-26(30)22-9-7-20(8-10-22)15-17-29-18-16-21-5-3-4-6-24(21)19-29/h3-14H,2,15-19H2,1H3,(H,28,30)
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n/an/a 1.06E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62252
PNG
(1-[2-methyl-5-(4-phenylpiperazin-1-yl)sulfonyl-2,3...)
Show SMILES CC1Cc2cc(ccc2N1C(C)=O)S(=O)(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16-14-18-15-20(8-9-21(18)24(16)17(2)25)28(26,27)23-12-10-22(11-13-23)19-6-4-3-5-7-19/h3-9,15-16H,10-14H2,1-2H3
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n/an/a 1.12E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62334
PNG
(1-[(4-chlorophenyl)methyl]-2-benzimidazolamine | 1...)
Show SMILES Nc1nc2ccccc2n1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C14H12ClN3/c15-11-7-5-10(6-8-11)9-18-13-4-2-1-3-12(13)17-14(18)16/h1-8H,9H2,(H2,16,17)
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n/an/a 1.19E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62306
PNG
((1-nosylbenzimidazol-2-yl)amine | 1-(4-nitrophenyl...)
Show SMILES Nc1nc2ccccc2n1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C13H10N4O4S/c14-13-15-11-3-1-2-4-12(11)16(13)22(20,21)10-7-5-9(6-8-10)17(18)19/h1-8H,(H2,14,15)
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n/an/a 1.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM50380381
PNG
(CHEMBL2018276)
Show SMILES Nc1nc2ccccc2n1CCC(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H14ClN3O/c17-12-7-5-11(6-8-12)15(21)9-10-20-14-4-2-1-3-13(14)19-16(20)18/h1-8H,9-10H2,(H2,18,19)
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n/an/a 1.63E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62325
PNG
(1-[4-[4-(1-acetylindolin-5-yl)sulfonylpiperazino]p...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C22H25N3O4S/c1-16(26)18-3-5-20(6-4-18)23-11-13-24(14-12-23)30(28,29)21-7-8-22-19(15-21)9-10-25(22)17(2)27/h3-8,15H,9-14H2,1-2H3
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n/an/a 1.74E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62255
PNG
(MLS-0364000.0001 | cid_20901630 | cyclopropyl-[2-m...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C23H27N3O3S/c1-17-15-19-16-21(9-10-22(19)26(17)23(27)18-7-8-18)30(28,29)25-13-11-24(12-14-25)20-5-3-2-4-6-20/h2-6,9-10,16-18H,7-8,11-15H2,1H3
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n/an/a 1.74E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62314
PNG
((2-amino-1-benzimidazolyl)-(4-fluorophenyl)methano...)
Show SMILES Nc1nc2ccccc2n1C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C14H10FN3O/c15-10-7-5-9(6-8-10)13(19)18-12-4-2-1-3-11(12)17-14(18)16/h1-8H,(H2,16,17)
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n/an/a 1.80E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62170
PNG
(1-(4-chlorophenyl)sulfonyl-2-benzimidazolamine | 1...)
Show SMILES Nc1nc2ccccc2n1S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H10ClN3O2S/c14-9-5-7-10(8-6-9)20(18,19)17-12-4-2-1-3-11(12)16-13(17)15/h1-8H,(H2,15,16)
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n/an/a 1.99E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62242
PNG
(4-(piperidinomethyl)-N-p-phenetyl-benzamide | MLS-...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C21H26N2O2/c1-2-25-20-12-10-19(11-13-20)22-21(24)18-8-6-17(7-9-18)16-23-14-4-3-5-15-23/h6-13H,2-5,14-16H2,1H3,(H,22,24)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62244
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-fluorophenyl)...)
Show SMILES Fc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C22H19FN2O/c23-19-9-11-20(12-10-19)24-22(26)18-7-5-16(6-8-18)15-25-14-13-17-3-1-2-4-21(17)25/h1-12H,13-15H2,(H,24,26)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62287
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-[4-(dimethylamin...)
Show SMILES CN(C)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C24H25N3O/c1-26(2)22-13-11-21(12-14-22)25-24(28)20-9-7-18(8-10-20)17-27-16-15-19-5-3-4-6-23(19)27/h3-14H,15-17H2,1-2H3,(H,25,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62322
PNG
(1-[5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-2,3...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C21H24N4O5S/c1-2-21(26)24-10-9-16-15-19(7-8-20(16)24)31(29,30)23-13-11-22(12-14-23)17-3-5-18(6-4-17)25(27)28/h3-8,15H,2,9-14H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62242
PNG
(4-(piperidinomethyl)-N-p-phenetyl-benzamide | MLS-...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C21H26N2O2/c1-2-25-20-12-10-19(11-13-20)22-21(24)18-8-6-17(7-9-18)16-23-14-4-3-5-15-23/h6-13H,2-5,14-16H2,1H3,(H,22,24)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62287
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-[4-(dimethylamin...)
Show SMILES CN(C)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C24H25N3O/c1-26(2)22-13-11-21(12-14-22)25-24(28)20-9-7-18(8-10-20)17-27-16-15-19-5-3-4-6-23(19)27/h3-14H,15-17H2,1-2H3,(H,25,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62290
PNG
(4-[[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]be...)
Show SMILES CCOC(=O)c1ccc(NC(=O)c2ccc(CCN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C27H28N2O3/c1-2-32-27(31)23-11-13-25(14-12-23)28-26(30)22-9-7-20(8-10-22)15-17-29-18-16-21-5-3-4-6-24(21)19-29/h3-14H,2,15-19H2,1H3,(H,28,30)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62322
PNG
(1-[5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-2,3...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C21H24N4O5S/c1-2-21(26)24-10-9-16-15-19(7-8-20(16)24)31(29,30)23-13-11-22(12-14-23)17-3-5-18(6-4-17)25(27)28/h3-8,15H,2,9-14H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM50380381
PNG
(CHEMBL2018276)
Show SMILES Nc1nc2ccccc2n1CCC(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H14ClN3O/c17-12-7-5-11(6-8-12)15(21)9-10-20-14-4-2-1-3-13(14)19-16(20)18/h1-8H,9-10H2,(H2,18,19)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62289
PNG
(4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-N-(4-...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CCN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C26H28N2O2/c1-2-30-25-13-11-24(12-14-25)27-26(29)22-9-7-20(8-10-22)15-17-28-18-16-21-5-3-4-6-23(21)19-28/h3-14H,2,15-19H2,1H3,(H,27,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62292
PNG
(MLS-0412189.0001 | N-[4-(3,4-dihydro-1H-isoquinoli...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(CN2CCc3ccccc3C2)cc1
Show InChI InChI=1S/C25H26N2O2/c1-2-29-24-13-9-21(10-14-24)25(28)26-23-11-7-19(8-12-23)17-27-16-15-20-5-3-4-6-22(20)18-27/h3-14H,2,15-18H2,1H3,(H,26,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62307
PNG
((5,6-dimethyl-1-tosyl-benzimidazol-2-yl)amine | 5,...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2cc(C)c(C)cc12
Show InChI InChI=1S/C16H17N3O2S/c1-10-4-6-13(7-5-10)22(20,21)19-15-9-12(3)11(2)8-14(15)18-16(19)17/h4-9H,1-3H3,(H2,17,18)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62238
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2,...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H24ClN3O3S/c1-2-21(26)25-10-9-16-15-19(7-8-20(16)25)29(27,28)24-13-11-23(12-14-24)18-5-3-17(22)4-6-18/h3-8,15H,2,9-14H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62294
PNG
(4-[4-(1-propionylindolin-5-yl)sulfonylpiperazino]b...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H24N4O3S/c1-2-22(27)26-10-9-18-15-20(7-8-21(18)26)30(28,29)25-13-11-24(12-14-25)19-5-3-17(16-23)4-6-19/h3-8,15H,2,9-14H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62342
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2,...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H22ClN3O3S/c1-15(25)24-9-8-16-14-19(6-7-20(16)24)28(26,27)23-12-10-22(11-13-23)18-4-2-17(21)3-5-18/h2-7,14H,8-13H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62335
PNG
(4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-met...)
Show SMILES Cc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H24N2O/c1-18-6-12-23(13-7-18)25-24(27)21-10-8-19(9-11-21)16-26-15-14-20-4-2-3-5-22(20)17-26/h2-13H,14-17H2,1H3,(H,25,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62330
PNG
(MLS-0425629.0001 | N-(4-chlorophenyl)-4-[2-(3,4-di...)
Show SMILES Clc1ccc(NC(=O)c2ccc(CCN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H23ClN2O/c25-22-9-11-23(12-10-22)26-24(28)20-7-5-18(6-8-20)13-15-27-16-14-19-3-1-2-4-21(19)17-27/h1-12H,13-17H2,(H,26,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62308
PNG
(MLS-0412191.0001 | [5-[4-(4-chlorophenyl)piperazin...)
Show SMILES Clc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1
Show InChI InChI=1S/C22H24ClN3O3S/c23-18-3-5-19(6-4-18)24-11-13-25(14-12-24)30(28,29)20-7-8-21-17(15-20)9-10-26(21)22(27)16-1-2-16/h3-8,15-16H,1-2,9-14H2
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62326
PNG
(1-[5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-2,3...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C20H22N4O5S/c1-15(25)23-9-8-16-14-19(6-7-20(16)23)30(28,29)22-12-10-21(11-13-22)17-2-4-18(5-3-17)24(26)27/h2-7,14H,8-13H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62258
PNG
(MLS-0412145.0001 | N-(4-methoxyphenyl)-4-(1-piperi...)
Show SMILES COc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C20H24N2O2/c1-24-19-11-9-18(10-12-19)21-20(23)17-7-5-16(6-8-17)15-22-13-3-2-4-14-22/h5-12H,2-4,13-15H2,1H3,(H,21,23)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62259
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-methoxyphenyl...)
Show SMILES COc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C23H22N2O2/c1-27-21-12-10-20(11-13-21)24-23(26)19-8-6-17(7-9-19)16-25-15-14-18-4-2-3-5-22(18)25/h2-13H,14-16H2,1H3,(H,24,26)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62312
PNG
(2-methyl-1-(4-methylphenyl)sulfonyl-benzimidazole ...)
Show SMILES Cc1nc2ccccc2n1S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C15H14N2O2S/c1-11-7-9-13(10-8-11)20(18,19)17-12(2)16-14-5-3-4-6-15(14)17/h3-10H,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62326
PNG
(1-[5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-2,3...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C20H22N4O5S/c1-15(25)23-9-8-16-14-19(6-7-20(16)23)30(28,29)22-12-10-21(11-13-22)17-2-4-18(5-3-17)24(26)27/h2-7,14H,8-13H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62241
PNG
(MLS-0412075.0001 | N-(4-fluorophenyl)-4-(1-piperid...)
Show SMILES Fc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C19H21FN2O/c20-17-8-10-18(11-9-17)21-19(23)16-6-4-15(5-7-16)14-22-12-2-1-3-13-22/h4-11H,1-3,12-14H2,(H,21,23)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62244
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-fluorophenyl)...)
Show SMILES Fc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C22H19FN2O/c23-19-9-11-20(12-10-19)24-22(26)18-7-5-16(6-8-18)15-25-14-13-17-3-1-2-4-21(17)25/h1-12H,13-15H2,(H,24,26)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62285
PNG
(MLS-0412182.0001 | N-[4-(dimethylamino)phenyl]-4-(...)
Show SMILES CN(C)c1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C21H27N3O/c1-23(2)20-12-10-19(11-13-20)22-21(25)18-8-6-17(7-9-18)16-24-14-4-3-5-15-24/h6-13H,3-5,14-16H2,1-2H3,(H,22,25)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62292
PNG
(MLS-0412189.0001 | N-[4-(3,4-dihydro-1H-isoquinoli...)
Show SMILES CCOc1ccc(cc1)C(=O)Nc1ccc(CN2CCc3ccccc3C2)cc1
Show InChI InChI=1S/C25H26N2O2/c1-2-29-24-13-9-21(10-14-24)25(28)26-23-11-7-19(8-12-23)17-27-16-15-20-5-3-4-6-22(20)18-27/h3-14H,2,15-18H2,1H3,(H,26,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM59542
PNG
((1-tosylbenzimidazol-2-yl)amine | 1-(4-methylpheny...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C14H13N3O2S/c1-10-6-8-11(9-7-10)20(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62317
PNG
(1-[4-[4-[(1-cyclopropylcarbonyl-2,3-dihydroindol-5...)
Show SMILES CC(=O)c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1
Show InChI InChI=1S/C24H27N3O4S/c1-17(28)18-4-6-21(7-5-18)25-12-14-26(15-13-25)32(30,31)22-8-9-23-20(16-22)10-11-27(23)24(29)19-2-3-19/h4-9,16,19H,2-3,10-15H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62255
PNG
(MLS-0364000.0001 | cid_20901630 | cyclopropyl-[2-m...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C23H27N3O3S/c1-17-15-19-16-21(9-10-22(19)26(17)23(27)18-7-8-18)30(28,29)25-13-11-24(12-14-25)20-5-3-2-4-6-20/h2-6,9-10,16-18H,7-8,11-15H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62241
PNG
(MLS-0412075.0001 | N-(4-fluorophenyl)-4-(1-piperid...)
Show SMILES Fc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C19H21FN2O/c20-17-8-10-18(11-9-17)21-19(23)16-6-4-15(5-7-16)14-22-12-2-1-3-13-22/h4-11H,1-3,12-14H2,(H,21,23)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62307
PNG
((5,6-dimethyl-1-tosyl-benzimidazol-2-yl)amine | 5,...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2cc(C)c(C)cc12
Show InChI InChI=1S/C16H17N3O2S/c1-10-4-6-13(7-5-10)22(20,21)19-15-9-12(3)11(2)8-14(15)18-16(19)17/h4-9H,1-3H3,(H2,17,18)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62285
PNG
(MLS-0412182.0001 | N-[4-(dimethylamino)phenyl]-4-(...)
Show SMILES CN(C)c1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C21H27N3O/c1-23(2)20-12-10-19(11-13-20)22-21(25)18-8-6-17(7-9-18)16-24-14-4-3-5-15-24/h6-13H,3-5,14-16H2,1-2H3,(H,22,25)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62315
PNG
(4-[4-[(1-cyclopropylcarbonyl-2,3-dihydroindol-5-yl...)
Show SMILES O=C(C1CC1)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N4O3S/c24-16-17-1-5-20(6-2-17)25-11-13-26(14-12-25)31(29,30)21-7-8-22-19(15-21)9-10-27(22)23(28)18-3-4-18/h1-2,5-8,15,18H,3-4,9-14H2
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62258
PNG
(MLS-0412145.0001 | N-(4-methoxyphenyl)-4-(1-piperi...)
Show SMILES COc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C20H24N2O2/c1-24-19-11-9-18(10-12-19)21-20(23)17-7-5-16(6-8-17)15-22-13-3-2-4-14-22/h5-12H,2-4,13-15H2,1H3,(H,21,23)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62262
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-methylsulfany...)
Show SMILES CSc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C23H22N2OS/c1-27-21-12-10-20(11-13-21)24-23(26)19-8-6-17(7-9-19)16-25-15-14-18-4-2-3-5-22(18)25/h2-13H,14-16H2,1H3,(H,24,26)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62289
PNG
(4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-N-(4-...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CCN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C26H28N2O2/c1-2-30-25-13-11-24(12-14-25)27-26(29)22-9-7-20(8-10-22)15-17-28-18-16-21-5-3-4-6-23(21)19-28/h3-14H,2,15-19H2,1H3,(H,27,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62291
PNG
(4-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzo...)
Show SMILES OS(=O)(=O)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H22N2O4S/c26-23(24-21-9-11-22(12-10-21)30(27,28)29)19-7-5-17(6-8-19)15-25-14-13-18-3-1-2-4-20(18)16-25/h1-12H,13-16H2,(H,24,26)(H,27,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62172
PNG
(1-(4-methoxyphenyl)sulfonyl-2-benzimidazolamine | ...)
Show SMILES COc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12
Show InChI InChI=1S/C14H13N3O3S/c1-20-10-6-8-11(9-7-10)21(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62321
PNG
(1-[5-[4-(4-acetylphenyl)piperazin-1-yl]sulfonyl-2,...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C23H27N3O4S/c1-3-23(28)26-11-10-19-16-21(8-9-22(19)26)31(29,30)25-14-12-24(13-15-25)20-6-4-18(5-7-20)17(2)27/h4-9,16H,3,10-15H2,1-2H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62328
PNG
(2-(2-amino-1-benzimidazolyl)-1-(4-methoxyphenyl)et...)
Show SMILES COc1ccc(cc1)C(=O)Cn1c(N)nc2ccccc12
Show InChI InChI=1S/C16H15N3O2/c1-21-12-8-6-11(7-9-12)15(20)10-19-14-5-3-2-4-13(14)18-16(19)17/h2-9H,10H2,1H3,(H2,17,18)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62342
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2,...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H22ClN3O3S/c1-15(25)24-9-8-16-14-19(6-7-20(16)24)28(26,27)23-12-10-22(11-13-23)18-4-2-17(21)3-5-18/h2-7,14H,8-13H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62291
PNG
(4-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzo...)
Show SMILES OS(=O)(=O)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C23H22N2O4S/c26-23(24-21-9-11-22(12-10-21)30(27,28)29)19-7-5-17(6-8-19)15-25-14-13-18-3-1-2-4-20(18)16-25/h1-12H,13-16H2,(H,24,26)(H,27,28,29)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM50380380
PNG
(CHEMBL2018275)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c2cc(C)ccc2[nH]c1=S
Show InChI InChI=1S/C15H14N2O2S2/c1-10-3-6-12(7-4-10)21(18,19)17-14-9-11(2)5-8-13(14)16-15(17)20/h3-9H,1-2H3,(H,16,20)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62328
PNG
(2-(2-amino-1-benzimidazolyl)-1-(4-methoxyphenyl)et...)
Show SMILES COc1ccc(cc1)C(=O)Cn1c(N)nc2ccccc12
Show InChI InChI=1S/C16H15N3O2/c1-21-12-8-6-11(7-9-12)15(20)10-19-14-5-3-2-4-13(14)18-16(19)17/h2-9H,10H2,1H3,(H2,17,18)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62259
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-methoxyphenyl...)
Show SMILES COc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C23H22N2O2/c1-27-21-12-10-20(11-13-21)24-23(26)19-8-6-17(7-9-19)16-25-15-14-18-4-2-3-5-22(18)25/h2-13H,14-16H2,1H3,(H,24,26)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM50380380
PNG
(CHEMBL2018275)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c2cc(C)ccc2[nH]c1=S
Show InChI InChI=1S/C15H14N2O2S2/c1-10-3-6-12(7-4-10)21(18,19)17-14-9-11(2)5-8-13(14)16-15(17)20/h3-9H,1-2H3,(H,16,20)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62294
PNG
(4-[4-(1-propionylindolin-5-yl)sulfonylpiperazino]b...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H24N4O3S/c1-2-22(27)26-10-9-18-15-20(7-8-21(18)26)30(28,29)25-13-11-24(12-14-25)19-5-3-17(16-23)4-6-19/h3-8,15H,2,9-14H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62243
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-ethoxyphenyl)...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C24H24N2O2/c1-2-28-22-13-11-21(12-14-22)25-24(27)20-9-7-18(8-10-20)17-26-16-15-19-5-3-4-6-23(19)26/h3-14H,2,15-17H2,1H3,(H,25,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62262
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-methylsulfany...)
Show SMILES CSc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C23H22N2OS/c1-27-21-12-10-20(11-13-21)24-23(26)19-8-6-17(7-9-19)16-25-15-14-18-4-2-3-5-22(18)25/h2-13H,14-16H2,1H3,(H,24,26)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62331
PNG
(4-chloranyl-N-[4-(3,4-dihydro-1H-isoquinolin-2-ylm...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(CN2CCc3ccccc3C2)cc1
Show InChI InChI=1S/C23H21ClN2O/c24-21-9-7-19(8-10-21)23(27)25-22-11-5-17(6-12-22)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62317
PNG
(1-[4-[4-[(1-cyclopropylcarbonyl-2,3-dihydroindol-5...)
Show SMILES CC(=O)c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1
Show InChI InChI=1S/C24H27N3O4S/c1-17(28)18-4-6-21(7-5-18)25-12-14-26(15-13-25)32(30,31)22-8-9-23-20(16-22)10-11-27(23)24(29)19-2-3-19/h4-9,16,19H,2-3,10-15H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62321
PNG
(1-[5-[4-(4-acetylphenyl)piperazin-1-yl]sulfonyl-2,...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C23H27N3O4S/c1-3-23(28)26-11-10-19-16-21(8-9-22(19)26)31(29,30)25-14-12-24(13-15-25)20-6-4-18(5-7-20)17(2)27/h4-9,16H,3,10-15H2,1-2H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62325
PNG
(1-[4-[4-(1-acetylindolin-5-yl)sulfonylpiperazino]p...)
Show SMILES CC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(C)=O
Show InChI InChI=1S/C22H25N3O4S/c1-16(26)18-3-5-20(6-4-18)23-11-13-24(14-12-23)30(28,29)21-7-8-22-19(15-21)9-10-25(22)17(2)27/h3-8,15H,9-14H2,1-2H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62243
PNG
(4-(2,3-dihydroindol-1-ylmethyl)-N-(4-ethoxyphenyl)...)
Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCc4ccccc34)cc2)cc1
Show InChI InChI=1S/C24H24N2O2/c1-2-28-22-13-11-21(12-14-22)25-24(27)20-9-7-18(8-10-20)17-26-16-15-19-5-3-4-6-23(19)26/h3-14H,2,15-17H2,1H3,(H,25,27)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62260
PNG
(MLS-0412147.0001 | N-(4-methylsulfanylphenyl)-4-(p...)
Show SMILES CSc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C20H24N2OS/c1-24-19-11-9-18(10-12-19)21-20(23)17-7-5-16(6-8-17)15-22-13-3-2-4-14-22/h5-12H,2-4,13-15H2,1H3,(H,21,23)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62331
PNG
(4-chloranyl-N-[4-(3,4-dihydro-1H-isoquinolin-2-ylm...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(CN2CCc3ccccc3C2)cc1
Show InChI InChI=1S/C23H21ClN2O/c24-21-9-7-19(8-10-21)23(27)25-22-11-5-17(6-12-22)15-26-14-13-18-3-1-2-4-20(18)16-26/h1-12H,13-16H2,(H,25,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62312
PNG
(2-methyl-1-(4-methylphenyl)sulfonyl-benzimidazole ...)
Show SMILES Cc1nc2ccccc2n1S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C15H14N2O2S/c1-11-7-9-13(10-8-11)20(18,19)17-12(2)16-14-5-3-4-6-15(14)17/h3-10H,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62315
PNG
(4-[4-[(1-cyclopropylcarbonyl-2,3-dihydroindol-5-yl...)
Show SMILES O=C(C1CC1)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N4O3S/c24-16-17-1-5-20(6-2-17)25-11-13-26(14-12-25)31(29,30)21-7-8-22-19(15-21)9-10-27(22)23(28)18-3-4-18/h1-2,5-8,15,18H,3-4,9-14H2
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62313
PNG
(1-(2-amino-1-benzimidazolyl)-2-phenylethanone | 1-...)
Show SMILES Nc1nc2ccccc2n1C(=O)Cc1ccccc1
Show InChI InChI=1S/C15H13N3O/c16-15-17-12-8-4-5-9-13(12)18(15)14(19)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,17)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62260
PNG
(MLS-0412147.0001 | N-(4-methylsulfanylphenyl)-4-(p...)
Show SMILES CSc1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)cc1
Show InChI InChI=1S/C20H24N2OS/c1-24-19-11-9-18(10-12-19)21-20(23)17-7-5-16(6-8-17)15-22-13-3-2-4-14-22/h5-12H,2-4,13-15H2,1H3,(H,21,23)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62313
PNG
(1-(2-amino-1-benzimidazolyl)-2-phenylethanone | 1-...)
Show SMILES Nc1nc2ccccc2n1C(=O)Cc1ccccc1
Show InChI InChI=1S/C15H13N3O/c16-15-17-12-8-4-5-9-13(12)18(15)14(19)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,16,17)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62308
PNG
(MLS-0412191.0001 | [5-[4-(4-chlorophenyl)piperazin...)
Show SMILES Clc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1
Show InChI InChI=1S/C22H24ClN3O3S/c23-18-3-5-19(6-4-18)24-11-13-25(14-12-24)30(28,29)20-7-8-21-17(15-20)9-10-26(21)22(27)16-1-2-16/h3-8,15-16H,1-2,9-14H2
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62171
PNG
((1-besylbenzimidazol-2-yl)amine | 1-(benzenesulfon...)
Show SMILES Nc1nc2ccccc2n1S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H11N3O2S/c14-13-15-11-8-4-5-9-12(11)16(13)19(17,18)10-6-2-1-3-7-10/h1-9H,(H2,14,15)
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n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62256
PNG
(MLS-0412144.0001 | cid_44182147 | cyclopropyl-[2-m...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(C)cc1
Show InChI InChI=1S/C24H29N3O3S/c1-17-3-7-21(8-4-17)25-11-13-26(14-12-25)31(29,30)22-9-10-23-20(16-22)15-18(2)27(23)24(28)19-5-6-19/h3-4,7-10,16,18-19H,5-6,11-15H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62330
PNG
(MLS-0425629.0001 | N-(4-chlorophenyl)-4-[2-(3,4-di...)
Show SMILES Clc1ccc(NC(=O)c2ccc(CCN3CCc4ccccc4C3)cc2)cc1
Show InChI InChI=1S/C24H23ClN2O/c25-22-9-11-23(12-10-22)26-24(28)20-7-5-18(6-8-20)13-15-27-16-14-19-3-1-2-4-21(19)17-27/h1-12H,13-17H2,(H,26,28)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62256
PNG
(MLS-0412144.0001 | cid_44182147 | cyclopropyl-[2-m...)
Show SMILES CC1Cc2cc(ccc2N1C(=O)C1CC1)S(=O)(=O)N1CCN(CC1)c1ccc(C)cc1
Show InChI InChI=1S/C24H29N3O3S/c1-17-3-7-21(8-4-17)25-11-13-26(14-12-25)31(29,30)22-9-10-23-20(16-22)15-18(2)27(23)24(28)19-5-6-19/h3-4,7-10,16,18-19H,5-6,11-15H2,1-2H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62306
PNG
((1-nosylbenzimidazol-2-yl)amine | 1-(4-nitrophenyl...)
Show SMILES Nc1nc2ccccc2n1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C13H10N4O4S/c14-13-15-11-3-1-2-4-12(11)16(13)22(20,21)10-7-5-9(6-8-10)17(18)19/h1-8H,(H2,14,15)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62169
PNG
(1-(4-methylphenyl)sulfonylbenzimidazole | 1-tosylb...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cnc2ccccc12
Show InChI InChI=1S/C14H12N2O2S/c1-11-6-8-12(9-7-11)19(17,18)16-10-15-13-4-2-3-5-14(13)16/h2-10H,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))		BDBM62238
PNG
(1-[5-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-2,...)
Show SMILES CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H24ClN3O3S/c1-2-21(26)25-10-9-16-15-19(7-8-20(16)25)29(27,28)24-13-11-23(12-14-24)18-5-3-17(22)4-6-18/h3-8,15H,2,9-14H2,1H3
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TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-1 mediated NFkappaB activation in HEK293T cells assessed as inhibition of gamma-tri-DAP-induced luciferase activity after 14 hrs by...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))		BDBM62314
PNG
((2-amino-1-benzimidazolyl)-(4-fluorophenyl)methano...)
Show SMILES Nc1nc2ccccc2n1C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C14H10FN3O/c15-10-7-5-9(6-8-10)13(19)18-12-4-2-1-3-11(12)17-14(18)16/h1-8H,(H2,16,17)
PDB

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KEGG

UniProtKB/SwissProt

antibodypedia
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PC cid
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UniChem

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PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of NOD-2 mediated NFkappaB activation in HEK293T cells assessed as inhibition of MDP-induced luciferase activity after 14 hrs by reporter ...

ACS Med Chem Lett 2: 780-785 (2011)


Article DOI: 10.1021/ml200158b
BindingDB Entry DOI: 10.7270/Q2H9966Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%