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PubMed code 20005703

Compile data set for download or QSAR
Found 66 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
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415315
PNG
(CHEMBL593835)
Show SMILES Clc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H14ClN3O/c15-12-4-2-1-3-11(12)13-5-6-14(17-16-13)18-7-9-19-10-8-18/h1-6H,7-10H2
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n/an/an/an/a 1.58E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415321
PNG
(CHEMBL595008)
Show SMILES COc1ccc(c(Cl)c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H16ClN3O2/c1-20-11-2-3-12(13(16)10-11)14-4-5-15(18-17-14)19-6-8-21-9-7-19/h2-5,10H,6-9H2,1H3
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415328
PNG
(CHEMBL611620)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cncc2ccccc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-7-8-14(2)23(13)19-10-9-18(21-22-19)17-12-20-11-15-5-3-4-6-16(15)17/h3-6,9-14H,7-8H2,1-2H3/t13-,14+
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n/an/an/an/a 7.94E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415303
PNG
(CHEMBL594977)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-11-3-1-2-10(14(11)16)12-4-5-13(18-17-12)19-6-8-20-9-7-19/h1-5H,6-9H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415309
PNG
(CHEMBL608700)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCS(=O)(=O)CC1
Show InChI InChI=1S/C14H13Cl2N3O2S/c15-11-3-1-2-10(14(11)16)12-4-5-13(18-17-12)19-6-8-22(20,21)9-7-19/h1-5H,6-9H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415133
PNG
(CHEMBL577347)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nc1)N1CCOCC1
Show InChI InChI=1S/C15H14Cl2N2O/c16-13-3-1-2-12(15(13)17)11-4-5-14(18-10-11)19-6-8-20-9-7-19/h1-5,10H,6-9H2
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n/an/an/an/a 79.4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415306
PNG
(CHEMBL594056)
Show SMILES Clc1cccc(c1Cl)-c1cnc(nn1)N1CCOCC1
Show InChI InChI=1S/C13H12Cl2N4O/c14-10-3-1-2-9(12(10)15)11-8-16-13(18-17-11)19-4-6-20-7-5-19/h1-3,8H,4-7H2
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n/an/an/an/a 100n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415317
PNG
(CHEMBL593130)
Show SMILES FC(F)(F)c1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H14F3N3O/c16-15(17,18)12-4-2-1-3-11(12)13-5-6-14(20-19-13)21-7-9-22-10-8-21/h1-6H,7-10H2
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n/an/an/an/a 1.26E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415319
PNG
(CHEMBL595450)
Show SMILES Clc1ccc(c(Cl)c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-10-1-2-11(12(16)9-10)13-3-4-14(18-17-13)19-5-7-20-8-6-19/h1-4,9H,5-8H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415332
PNG
(CHEMBL611321)
Show SMILES FC(F)(F)c1cccc(c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H14F3N3O/c16-15(17,18)12-3-1-2-11(10-12)13-4-5-14(20-19-13)21-6-8-22-9-7-21/h1-5,10H,6-9H2
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n/an/an/an/a 1.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415325
PNG
(CHEMBL608702)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cc2ccccc2o1 |r|
Show InChI InChI=1S/C18H19N3O/c1-12-7-8-13(2)21(12)18-10-9-15(19-20-18)17-11-14-5-3-4-6-16(14)22-17/h3-6,9-13H,7-8H2,1-2H3/t12-,13+
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n/an/an/an/a 158n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415327
PNG
(CHEMBL593582)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc2cccnc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-8-9-14(2)23(13)18-11-10-17(21-22-18)16-7-3-5-15-6-4-12-20-19(15)16/h3-7,10-14H,8-9H2,1-2H3/t13-,14+
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n/an/an/an/a 79.4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415313
PNG
(CHEMBL594531)
Show SMILES Clc1cccc(c1Cl)-c1ccc(NC2CCCCC2)nn1
Show InChI InChI=1S/C16H17Cl2N3/c17-13-8-4-7-12(16(13)18)14-9-10-15(21-20-14)19-11-5-2-1-3-6-11/h4,7-11H,1-3,5-6H2,(H,19,21)
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415335
PNG
(CHEMBL596569)
Show SMILES Clc1ccc(Cl)c(c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-10-1-2-12(16)11(9-10)13-3-4-14(18-17-13)19-5-7-20-8-6-19/h1-4,9H,5-8H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415302
PNG
(CHEMBL608403)
Show SMILES Clc1cccc(c1Cl)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C16H15Cl2NO/c17-15-3-1-2-14(16(15)18)12-4-6-13(7-5-12)19-8-10-20-11-9-19/h1-7H,8-11H2
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n/an/an/an/a 39.8n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415309
PNG
(CHEMBL608700)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCS(=O)(=O)CC1
Show InChI InChI=1S/C14H13Cl2N3O2S/c15-11-3-1-2-10(14(11)16)12-4-5-13(18-17-12)19-6-8-22(20,21)9-7-19/h1-5H,6-9H2
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n/an/an/an/a 631n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415322
PNG
(CHEMBL608698)
Show SMILES C(Oc1ccccc1-c1ccc(nn1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C21H21N3O2/c1-2-6-17(7-3-1)16-26-20-9-5-4-8-18(20)19-10-11-21(23-22-19)24-12-14-25-15-13-24/h1-11H,12-16H2
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n/an/an/an/a 3.98E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415324
PNG
(CHEMBL595244)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1c[nH]c2ccccc12 |r|
Show InChI InChI=1S/C18H20N4/c1-12-7-8-13(2)22(12)18-10-9-17(20-21-18)15-11-19-16-6-4-3-5-14(15)16/h3-6,9-13,19H,7-8H2,1-2H3/t12-,13+
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415325
PNG
(CHEMBL608702)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cc2ccccc2o1 |r|
Show InChI InChI=1S/C18H19N3O/c1-12-7-8-13(2)21(12)18-10-9-15(19-20-18)17-11-14-5-3-4-6-16(14)22-17/h3-6,9-13H,7-8H2,1-2H3/t12-,13+
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415326
PNG
(CHEMBL593581)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc2ncccc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-8-9-14(2)23(13)19-11-10-18(21-22-19)16-5-3-7-17-15(16)6-4-12-20-17/h3-7,10-14H,8-9H2,1-2H3/t13-,14+
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415327
PNG
(CHEMBL593582)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc2cccnc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-8-9-14(2)23(13)18-11-10-17(21-22-18)16-7-3-5-15-6-4-12-20-19(15)16/h3-7,10-14H,8-9H2,1-2H3/t13-,14+
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415319
PNG
(CHEMBL595450)
Show SMILES Clc1ccc(c(Cl)c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-10-1-2-11(12(16)9-10)13-3-4-14(18-17-13)19-5-7-20-8-6-19/h1-4,9H,5-8H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415329
PNG
(CHEMBL610914)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc2cnccc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-6-7-14(2)23(13)19-9-8-18(21-22-19)17-5-3-4-15-12-20-11-10-16(15)17/h3-5,8-14H,6-7H2,1-2H3/t13-,14+
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n/an/an/an/a 39.8n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415310
PNG
(CHEMBL595238)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCCC1
Show InChI InChI=1S/C14H13Cl2N3/c15-11-5-3-4-10(14(11)16)12-6-7-13(18-17-12)19-8-1-2-9-19/h3-7H,1-2,8-9H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415330
PNG
(CHEMBL611612)
Show SMILES COc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H17N3O2/c1-19-14-5-3-2-4-12(14)13-6-7-15(17-16-13)18-8-10-20-11-9-18/h2-7H,8-11H2,1H3
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415323
PNG
(CHEMBL595243)
Show SMILES C(Oc1cccc(c1)-c1ccc(nn1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C21H21N3O2/c1-2-5-17(6-3-1)16-26-19-8-4-7-18(15-19)20-9-10-21(23-22-20)24-11-13-25-14-12-24/h1-10,15H,11-14,16H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415330
PNG
(CHEMBL611612)
Show SMILES COc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H17N3O2/c1-19-14-5-3-2-4-12(14)13-6-7-15(17-16-13)18-8-10-20-11-9-18/h2-7H,8-11H2,1H3
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n/an/an/an/a 1.26E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415323
PNG
(CHEMBL595243)
Show SMILES C(Oc1cccc(c1)-c1ccc(nn1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C21H21N3O2/c1-2-5-17(6-3-1)16-26-19-8-4-7-18(15-19)20-9-10-21(23-22-20)24-11-13-25-14-12-24/h1-10,15H,11-14,16H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415314
PNG
(CHEMBL593834)
Show SMILES Clc1cccc(c1Cl)-c1ccc(NC2CCOCC2)nn1
Show InChI InChI=1S/C15H15Cl2N3O/c16-12-3-1-2-11(15(12)17)13-4-5-14(20-19-13)18-10-6-8-21-9-7-10/h1-5,10H,6-9H2,(H,18,20)
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415334
PNG
(CHEMBL610489)
Show SMILES FC(F)(F)c1cccc(-c2ccc(nn2)N2CCOCC2)c1C(F)(F)F
Show InChI InChI=1S/C16H13F6N3O/c17-15(18,19)11-3-1-2-10(14(11)16(20,21)22)12-4-5-13(24-23-12)25-6-8-26-9-7-25/h1-5H,6-9H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415313
PNG
(CHEMBL594531)
Show SMILES Clc1cccc(c1Cl)-c1ccc(NC2CCCCC2)nn1
Show InChI InChI=1S/C16H17Cl2N3/c17-13-8-4-7-12(16(13)18)14-9-10-15(21-20-14)19-11-5-2-1-3-6-11/h4,7-11H,1-3,5-6H2,(H,19,21)
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n/an/an/an/a 200n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415333
PNG
(CHEMBL596355)
Show SMILES Cc1cccc(c1C)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C16H19N3O/c1-12-4-3-5-14(13(12)2)15-6-7-16(18-17-15)19-8-10-20-11-9-19/h3-7H,8-11H2,1-2H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415320
PNG
(CHEMBL596155)
Show SMILES Cc1ccc(c(Cl)c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H16ClN3O/c1-11-2-3-12(13(16)10-11)14-4-5-15(18-17-14)19-6-8-20-9-7-19/h2-5,10H,6-9H2,1H3
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415307
PNG
(CHEMBL594281)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCCCC1
Show InChI InChI=1S/C15H15Cl2N3/c16-12-6-4-5-11(15(12)17)13-7-8-14(19-18-13)20-9-2-1-3-10-20/h4-8H,1-3,9-10H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415308
PNG
(CHEMBL594837)
Show SMILES FC1(F)CCN(CC1)c1ccc(nn1)-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H13Cl2F2N3/c16-11-3-1-2-10(14(11)17)12-4-5-13(21-20-12)22-8-6-15(18,19)7-9-22/h1-5H,6-9H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415312
PNG
(CHEMBL594530)
Show SMILES C[C@H]1C=C[C@@H](C)N1c1ccc(nn1)-c1cccc(Cl)c1Cl |r,c:2|
Show InChI InChI=1S/C16H15Cl2N3/c1-10-6-7-11(2)21(10)15-9-8-14(19-20-15)12-4-3-5-13(17)16(12)18/h3-11H,1-2H3/t10-,11+
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n/an/an/an/a 6.31E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415301
PNG
(CHEMBL594835)
Show SMILES Clc1cccc(c1Cl)-c1cnc(nc1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-12-3-1-2-11(13(12)16)10-8-17-14(18-9-10)19-4-6-20-7-5-19/h1-3,8-9H,4-7H2
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n/an/an/an/a 200n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415305
PNG
(CHEMBL608992)
Show SMILES Clc1cccc(c1Cl)-c1ncc(cn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-12-3-1-2-11(13(12)16)14-17-8-10(9-18-14)19-4-6-20-7-5-19/h1-3,8-9H,4-7H2
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n/an/an/an/a 50.1n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415312
PNG
(CHEMBL594530)
Show SMILES C[C@H]1C=C[C@@H](C)N1c1ccc(nn1)-c1cccc(Cl)c1Cl |r,c:2|
Show InChI InChI=1S/C16H15Cl2N3/c1-10-6-7-11(2)21(10)15-9-8-14(19-20-15)12-4-3-5-13(17)16(12)18/h3-11H,1-2H3/t10-,11+
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n/an/an/an/a 0.631n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415314
PNG
(CHEMBL593834)
Show SMILES Clc1cccc(c1Cl)-c1ccc(NC2CCOCC2)nn1
Show InChI InChI=1S/C15H15Cl2N3O/c16-12-3-1-2-11(15(12)17)13-4-5-14(20-19-13)18-10-6-8-21-9-7-10/h1-5,10H,6-9H2,(H,18,20)
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415320
PNG
(CHEMBL596155)
Show SMILES Cc1ccc(c(Cl)c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H16ClN3O/c1-11-2-3-12(13(16)10-11)14-4-5-15(18-17-14)19-6-8-20-9-7-19/h2-5,10H,6-9H2,1H3
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415311
PNG
(CHEMBL594529)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc(Cl)c1Cl |r|
Show InChI InChI=1S/C16H17Cl2N3/c1-10-6-7-11(2)21(10)15-9-8-14(19-20-15)12-4-3-5-13(17)16(12)18/h3-5,8-11H,6-7H2,1-2H3/t10-,11+
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n/an/an/an/a 2.51E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415316
PNG
(CHEMBL596590)
Show SMILES Cc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H17N3O/c1-12-4-2-3-5-13(12)14-6-7-15(17-16-14)18-8-10-19-11-9-18/h2-7H,8-11H2,1H3
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415332
PNG
(CHEMBL611321)
Show SMILES FC(F)(F)c1cccc(c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H14F3N3O/c16-15(17,18)12-3-1-2-11(10-12)13-4-5-14(20-19-13)21-6-8-22-9-7-21/h1-5,10H,6-9H2
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415303
PNG
(CHEMBL594977)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-11-3-1-2-10(14(11)16)12-4-5-13(18-17-12)19-6-8-20-9-7-19/h1-5H,6-9H2
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n/an/an/an/a 79.4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415304
PNG
(CHEMBL594055)
Show SMILES Clc1cccc(c1Cl)-c1cnc(cn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-11-3-1-2-10(14(11)16)12-8-18-13(9-17-12)19-4-6-20-7-5-19/h1-3,8-9H,4-7H2
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n/an/an/an/a 39.8n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415308
PNG
(CHEMBL594837)
Show SMILES FC1(F)CCN(CC1)c1ccc(nn1)-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C15H13Cl2F2N3/c16-11-3-1-2-10(14(11)17)12-4-5-13(21-20-12)22-8-6-15(18,19)7-9-22/h1-5H,6-9H2
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n/an/an/an/a 15.8n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415311
PNG
(CHEMBL594529)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc(Cl)c1Cl |r|
Show InChI InChI=1S/C16H17Cl2N3/c1-10-6-7-11(2)21(10)15-9-8-14(19-20-15)12-4-3-5-13(17)16(12)18/h3-5,8-11H,6-7H2,1-2H3/t10-,11+
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n/an/an/an/a 1.26n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415316
PNG
(CHEMBL596590)
Show SMILES Cc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H17N3O/c1-12-4-2-3-5-13(12)14-6-7-15(17-16-14)18-8-10-19-11-9-18/h2-7H,8-11H2,1H3
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n/an/an/an/a 7.94E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415335
PNG
(CHEMBL596569)
Show SMILES Clc1ccc(Cl)c(c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H13Cl2N3O/c15-10-1-2-12(16)11(9-10)13-3-4-14(18-17-13)19-5-7-20-8-6-19/h1-4,9H,5-8H2
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n/an/an/an/a 398n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415321
PNG
(CHEMBL595008)
Show SMILES COc1ccc(c(Cl)c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H16ClN3O2/c1-20-11-2-3-12(13(16)10-11)14-4-5-15(18-17-14)19-6-8-21-9-7-19/h2-5,10H,6-9H2,1H3
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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415322
PNG
(CHEMBL608698)
Show SMILES C(Oc1ccccc1-c1ccc(nn1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C21H21N3O2/c1-2-6-17(7-3-1)16-26-20-9-5-4-8-18(20)19-10-11-21(23-22-19)24-12-14-25-15-13-24/h1-11H,12-16H2
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n/an/an/an/a 631n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415324
PNG
(CHEMBL595244)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1c[nH]c2ccccc12 |r|
Show InChI InChI=1S/C18H20N4/c1-12-7-8-13(2)22(12)18-10-9-17(20-21-18)15-11-19-16-6-4-3-5-14(15)16/h3-6,9-13,19H,7-8H2,1-2H3/t12-,13+
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n/an/an/an/a 251n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415326
PNG
(CHEMBL593581)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc2ncccc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-8-9-14(2)23(13)19-11-10-18(21-22-19)16-5-3-7-17-15(16)6-4-12-20-17/h3-7,10-14H,8-9H2,1-2H3/t13-,14+
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n/an/an/an/a 200n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415328
PNG
(CHEMBL611620)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cncc2ccccc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-7-8-14(2)23(13)19-10-9-18(21-22-19)17-12-20-11-15-5-3-4-6-16(15)17/h3-6,9-14H,7-8H2,1-2H3/t13-,14+
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n/an/an/an/a 10n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415315
PNG
(CHEMBL593835)
Show SMILES Clc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H14ClN3O/c15-12-4-2-1-3-11(12)13-5-6-14(17-16-13)18-7-9-19-10-8-18/h1-6H,7-10H2
PDB

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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415317
PNG
(CHEMBL593130)
Show SMILES FC(F)(F)c1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H14F3N3O/c16-15(17,18)12-4-2-1-3-11(12)13-5-6-14(20-19-13)21-7-9-22-10-8-21/h1-6H,7-10H2
PDB

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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415331
PNG
(CHEMBL593131)
Show SMILES FC(F)(F)Oc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H14F3N3O2/c16-15(17,18)23-13-4-2-1-3-11(13)12-5-6-14(20-19-12)21-7-9-22-10-8-21/h1-6H,7-10H2
PDB

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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415307
PNG
(CHEMBL594281)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCCCC1
Show InChI InChI=1S/C15H15Cl2N3/c16-12-6-4-5-11(15(12)17)13-7-8-14(19-18-13)20-9-2-1-3-10-20/h4-8H,1-3,9-10H2
PDB

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n/an/an/an/a 6.31n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415310
PNG
(CHEMBL595238)
Show SMILES Clc1cccc(c1Cl)-c1ccc(nn1)N1CCCC1
Show InChI InChI=1S/C14H13Cl2N3/c15-11-5-3-4-10(14(11)16)12-6-7-13(18-17-12)19-8-1-2-9-19/h3-7H,1-2,8-9H2
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n/an/an/an/a 25.1n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415318
PNG
(CHEMBL595221)
Show SMILES Clc1cc(Cl)c(Cl)c(c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H12Cl3N3O/c15-9-7-10(14(17)11(16)8-9)12-1-2-13(19-18-12)20-3-5-21-6-4-20/h1-2,7-8H,3-6H2
PDB

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n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415329
PNG
(CHEMBL610914)
Show SMILES C[C@H]1CC[C@@H](C)N1c1ccc(nn1)-c1cccc2cnccc12 |r|
Show InChI InChI=1S/C19H20N4/c1-13-6-7-14(2)23(13)19-9-8-18(21-22-19)17-5-3-4-15-12-20-11-10-16(15)17/h3-5,8-14H,6-7H2,1-2H3/t13-,14+
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n/an/an/an/a 2.00E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415331
PNG
(CHEMBL593131)
Show SMILES FC(F)(F)Oc1ccccc1-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C15H14F3N3O2/c16-15(17,18)23-13-4-2-1-3-11(13)12-5-6-14(20-19-12)21-7-9-22-10-8-21/h1-6H,7-10H2
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n/an/an/an/a 1.26E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415334
PNG
(CHEMBL610489)
Show SMILES FC(F)(F)c1cccc(-c2ccc(nn2)N2CCOCC2)c1C(F)(F)F
Show InChI InChI=1S/C16H13F6N3O/c17-15(18,19)11-3-1-2-10(14(11)16(20,21)22)12-4-5-13(24-23-12)25-6-8-26-9-7-25/h1-5H,6-9H2
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n/an/an/an/a 158n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50415318
PNG
(CHEMBL595221)
Show SMILES Clc1cc(Cl)c(Cl)c(c1)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C14H12Cl3N3O/c15-9-7-10(14(17)11(16)8-9)12-1-2-13(19-18-12)20-3-5-21-6-4-20/h1-2,7-8H,3-6H2
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n/an/an/an/a 50.1n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50415333
PNG
(CHEMBL596355)
Show SMILES Cc1cccc(c1C)-c1ccc(nn1)N1CCOCC1
Show InChI InChI=1S/C16H19N3O/c1-12-4-3-5-14(13(12)2)15-6-7-16(18-17-15)19-8-10-20-11-9-19/h3-7H,8-11H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/an/a>3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor

Bioorg Med Chem Lett 20: 465-8 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.117
BindingDB Entry DOI: 10.7270/Q27M096D
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%