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Compile Data Set for Download or QSAR

Found 132 hits with Last Name = 'teramachi' and Initial = 'j'   
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))
BDBM50180022
PNG
(5-(4-chloro-3-methyl-phenyl)-1-(4-methyl-benzyl)-1...)
Show SMILES Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2C3(C)CCC(C3)C2(C)C)cc1 |THB:21:22:26.25:28|
Show InChI InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)
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2.10n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM21278
PNG
(5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl...)
Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Show InChI InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)
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10.6n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399121
PNG
(CHEMBL2179751)
Show SMILES CCCN(CCC)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C29H35N3O2/c1-3-19-32(20-4-2)26-17-15-25(16-18-26)29(30-27(33)21-23-11-7-5-8-12-23)31-28(34)22-24-13-9-6-10-14-24/h5-18,29H,3-4,19-22H2,1-2H3,(H,30,33)(H,31,34)
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22n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399121
PNG
(CHEMBL2179751)
Show SMILES CCCN(CCC)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C29H35N3O2/c1-3-19-32(20-4-2)26-17-15-25(16-18-26)29(30-27(33)21-23-11-7-5-8-12-23)31-28(34)22-24-13-9-6-10-14-24/h5-18,29H,3-4,19-22H2,1-2H3,(H,30,33)(H,31,34)
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22n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399122
PNG
(CHEMBL2179734)
Show SMILES CCCCCC(=O)NC(NC(=O)CCCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C23H39N3O2/c1-5-9-11-13-21(27)24-23(25-22(28)14-12-10-6-2)19-15-17-20(18-16-19)26(7-3)8-4/h15-18,23H,5-14H2,1-4H3,(H,24,27)(H,25,28)
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25n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399122
PNG
(CHEMBL2179734)
Show SMILES CCCCCC(=O)NC(NC(=O)CCCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C23H39N3O2/c1-5-9-11-13-21(27)24-23(25-22(28)14-12-10-6-2)19-15-17-20(18-16-19)26(7-3)8-4/h15-18,23H,5-14H2,1-4H3,(H,24,27)(H,25,28)
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25n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399120
PNG
(CHEMBL2179771)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C27H31N3O2/c1-3-30(4-2)24-17-15-23(16-18-24)27(28-25(31)19-21-11-7-5-8-12-21)29-26(32)20-22-13-9-6-10-14-22/h5-18,27H,3-4,19-20H2,1-2H3,(H,28,31)(H,29,32)
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64n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399120
PNG
(CHEMBL2179771)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C27H31N3O2/c1-3-30(4-2)24-17-15-23(16-18-24)27(28-25(31)19-21-11-7-5-8-12-21)29-26(32)20-22-13-9-6-10-14-22/h5-18,27H,3-4,19-20H2,1-2H3,(H,28,31)(H,29,32)
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64n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399119
PNG
(CHEMBL2179754)
Show SMILES O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C27H29N3O2/c31-25(19-21-9-3-1-4-10-21)28-27(29-26(32)20-22-11-5-2-6-12-22)23-13-15-24(16-14-23)30-17-7-8-18-30/h1-6,9-16,27H,7-8,17-20H2,(H,28,31)(H,29,32)
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71n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399119
PNG
(CHEMBL2179754)
Show SMILES O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C27H29N3O2/c31-25(19-21-9-3-1-4-10-21)28-27(29-26(32)20-22-11-5-2-6-12-22)23-13-15-24(16-14-23)30-17-7-8-18-30/h1-6,9-16,27H,7-8,17-20H2,(H,28,31)(H,29,32)
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71n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399118
PNG
(CHEMBL2179763)
Show SMILES CC(C)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C26H28N2O2/c1-19(2)22-13-15-23(16-14-22)26(27-24(29)17-20-9-5-3-6-10-20)28-25(30)18-21-11-7-4-8-12-21/h3-16,19,26H,17-18H2,1-2H3,(H,27,29)(H,28,30)
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85n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399118
PNG
(CHEMBL2179763)
Show SMILES CC(C)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C26H28N2O2/c1-19(2)22-13-15-23(16-14-22)26(27-24(29)17-20-9-5-3-6-10-20)28-25(30)18-21-11-7-4-8-12-21/h3-16,19,26H,17-18H2,1-2H3,(H,27,29)(H,28,30)
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85n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399117
PNG
(CHEMBL2179740)
Show SMILES FC(F)(F)c1ccc(cc1)C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H19Cl2F3N2O2/c25-19-9-1-15(2-10-19)13-21(32)30-23(17-5-7-18(8-6-17)24(27,28)29)31-22(33)14-16-3-11-20(26)12-4-16/h1-12,23H,13-14H2,(H,30,32)(H,31,33)
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101n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399117
PNG
(CHEMBL2179740)
Show SMILES FC(F)(F)c1ccc(cc1)C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H19Cl2F3N2O2/c25-19-9-1-15(2-10-19)13-21(32)30-23(17-5-7-18(8-6-17)24(27,28)29)31-22(33)14-16-3-11-20(26)12-4-16/h1-12,23H,13-14H2,(H,30,32)(H,31,33)
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101n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50399116
PNG
(CHEMBL2179762)
Show SMILES Cc1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C24H24N2O2/c1-18-12-14-21(15-13-18)24(25-22(27)16-19-8-4-2-5-9-19)26-23(28)17-20-10-6-3-7-11-20/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
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109n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399115
PNG
(CHEMBL2179735)
Show SMILES CCCCCCCC(=O)NC(NC(=O)CCCCCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C27H47N3O2/c1-5-9-11-13-15-17-25(31)28-27(29-26(32)18-16-14-12-10-6-2)23-19-21-24(22-20-23)30(7-3)8-4/h19-22,27H,5-18H2,1-4H3,(H,28,31)(H,29,32)
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146n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399115
PNG
(CHEMBL2179735)
Show SMILES CCCCCCCC(=O)NC(NC(=O)CCCCCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C27H47N3O2/c1-5-9-11-13-15-17-25(31)28-27(29-26(32)18-16-14-12-10-6-2)23-19-21-24(22-20-23)30(7-3)8-4/h19-22,27H,5-18H2,1-4H3,(H,28,31)(H,29,32)
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146n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399114
PNG
(CHEMBL2179759)
Show SMILES Clc1ccc(CC(=O)NC(NC(=O)Cc2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H19Cl3N2O2/c24-18-7-1-15(2-8-18)13-21(29)27-23(17-5-11-20(26)12-6-17)28-22(30)14-16-3-9-19(25)10-4-16/h1-12,23H,13-14H2,(H,27,29)(H,28,30)
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154n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399114
PNG
(CHEMBL2179759)
Show SMILES Clc1ccc(CC(=O)NC(NC(=O)Cc2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H19Cl3N2O2/c24-18-7-1-15(2-8-18)13-21(29)27-23(17-5-11-20(26)12-6-17)28-22(30)14-16-3-9-19(25)10-4-16/h1-12,23H,13-14H2,(H,27,29)(H,28,30)
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154n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399113
PNG
(CHEMBL2179739)
Show SMILES FC(F)(F)c1ccccc1C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H19Cl2F3N2O2/c25-17-9-5-15(6-10-17)13-21(32)30-23(19-3-1-2-4-20(19)24(27,28)29)31-22(33)14-16-7-11-18(26)12-8-16/h1-12,23H,13-14H2,(H,30,32)(H,31,33)
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158n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399113
PNG
(CHEMBL2179739)
Show SMILES FC(F)(F)c1ccccc1C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H19Cl2F3N2O2/c25-17-9-5-15(6-10-17)13-21(32)30-23(19-3-1-2-4-20(19)24(27,28)29)31-22(33)14-16-7-11-18(26)12-8-16/h1-12,23H,13-14H2,(H,30,32)(H,31,33)
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158n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399111
PNG
(CHEMBL2179736)
Show SMILES CCCCCCCCCC(=O)NC(NC(=O)CCCCCCCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C31H55N3O2/c1-5-9-11-13-15-17-19-21-29(35)32-31(27-23-25-28(26-24-27)34(7-3)8-4)33-30(36)22-20-18-16-14-12-10-6-2/h23-26,31H,5-22H2,1-4H3,(H,32,35)(H,33,36)
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160n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399111
PNG
(CHEMBL2179736)
Show SMILES CCCCCCCCCC(=O)NC(NC(=O)CCCCCCCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C31H55N3O2/c1-5-9-11-13-15-17-19-21-29(35)32-31(27-23-25-28(26-24-27)34(7-3)8-4)33-30(36)22-20-18-16-14-12-10-6-2/h23-26,31H,5-22H2,1-4H3,(H,32,35)(H,33,36)
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160n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399110
PNG
(CHEMBL2179728)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)\C=C\c1ccccc1)NC(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C29H31N3O2/c1-3-32(4-2)26-19-17-25(18-20-26)29(30-27(33)21-15-23-11-7-5-8-12-23)31-28(34)22-16-24-13-9-6-10-14-24/h5-22,29H,3-4H2,1-2H3,(H,30,33)(H,31,34)/b21-15+,22-16+
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167n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399110
PNG
(CHEMBL2179728)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)\C=C\c1ccccc1)NC(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C29H31N3O2/c1-3-32(4-2)26-19-17-25(18-20-26)29(30-27(33)21-15-23-11-7-5-8-12-23)31-28(34)22-16-24-13-9-6-10-14-24/h5-22,29H,3-4H2,1-2H3,(H,30,33)(H,31,34)/b21-15+,22-16+
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167n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399109
PNG
(CHEMBL2179733)
Show SMILES CCCCC(=O)NC(NC(=O)CCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C21H35N3O2/c1-5-9-11-19(25)22-21(23-20(26)12-10-6-2)17-13-15-18(16-14-17)24(7-3)8-4/h13-16,21H,5-12H2,1-4H3,(H,22,25)(H,23,26)
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182n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399109
PNG
(CHEMBL2179733)
Show SMILES CCCCC(=O)NC(NC(=O)CCCC)c1ccc(cc1)N(CC)CC
Show InChI InChI=1S/C21H35N3O2/c1-5-9-11-19(25)22-21(23-20(26)12-10-6-2)17-13-15-18(16-14-17)24(7-3)8-4/h13-16,21H,5-12H2,1-4H3,(H,22,25)(H,23,26)
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182n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399108
PNG
(CHEMBL2179753)
Show SMILES O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)c1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C37H35N3O2/c41-35(25-29-13-5-1-6-14-29)38-37(39-36(42)26-30-15-7-2-8-16-30)33-21-23-34(24-22-33)40(27-31-17-9-3-10-18-31)28-32-19-11-4-12-20-32/h1-24,37H,25-28H2,(H,38,41)(H,39,42)
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203n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399108
PNG
(CHEMBL2179753)
Show SMILES O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)c1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C37H35N3O2/c41-35(25-29-13-5-1-6-14-29)38-37(39-36(42)26-30-15-7-2-8-16-30)33-21-23-34(24-22-33)40(27-31-17-9-3-10-18-31)28-32-19-11-4-12-20-32/h1-24,37H,25-28H2,(H,38,41)(H,39,42)
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203n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399107
PNG
(CHEMBL2179727)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)CCc1ccccc1)NC(=O)CCc1ccccc1
Show InChI InChI=1S/C29H35N3O2/c1-3-32(4-2)26-19-17-25(18-20-26)29(30-27(33)21-15-23-11-7-5-8-12-23)31-28(34)22-16-24-13-9-6-10-14-24/h5-14,17-20,29H,3-4,15-16,21-22H2,1-2H3,(H,30,33)(H,31,34)
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213n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399107
PNG
(CHEMBL2179727)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)CCc1ccccc1)NC(=O)CCc1ccccc1
Show InChI InChI=1S/C29H35N3O2/c1-3-32(4-2)26-19-17-25(18-20-26)29(30-27(33)21-15-23-11-7-5-8-12-23)31-28(34)22-16-24-13-9-6-10-14-24/h5-14,17-20,29H,3-4,15-16,21-22H2,1-2H3,(H,30,33)(H,31,34)
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213n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399106
PNG
(CHEMBL2179752)
Show SMILES CCCCN(CCCC)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C31H39N3O2/c1-3-5-21-34(22-6-4-2)28-19-17-27(18-20-28)31(32-29(35)23-25-13-9-7-10-14-25)33-30(36)24-26-15-11-8-12-16-26/h7-20,31H,3-6,21-24H2,1-2H3,(H,32,35)(H,33,36)
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221n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399106
PNG
(CHEMBL2179752)
Show SMILES CCCCN(CCCC)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C31H39N3O2/c1-3-5-21-34(22-6-4-2)28-19-17-27(18-20-28)31(32-29(35)23-25-13-9-7-10-14-25)33-30(36)24-26-15-11-8-12-16-26/h7-20,31H,3-6,21-24H2,1-2H3,(H,32,35)(H,33,36)
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221n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399105
PNG
(CHEMBL2179738)
Show SMILES COc1ccc(cc1)C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H22Cl2N2O3/c1-31-21-12-6-18(7-13-21)24(27-22(29)14-16-2-8-19(25)9-3-16)28-23(30)15-17-4-10-20(26)11-5-17/h2-13,24H,14-15H2,1H3,(H,27,29)(H,28,30)
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310n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399105
PNG
(CHEMBL2179738)
Show SMILES COc1ccc(cc1)C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H22Cl2N2O3/c1-31-21-12-6-18(7-13-21)24(27-22(29)14-16-2-8-19(25)9-3-16)28-23(30)15-17-4-10-20(26)11-5-17/h2-13,24H,14-15H2,1H3,(H,27,29)(H,28,30)
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310n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399123
PNG
(CHEMBL2179766)
Show SMILES CC(C)Oc1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C26H28N2O3/c1-19(2)31-23-15-13-22(14-16-23)26(27-24(29)17-20-9-5-3-6-10-20)28-25(30)18-21-11-7-4-8-12-21/h3-16,19,26H,17-18H2,1-2H3,(H,27,29)(H,28,30)
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313n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399123
PNG
(CHEMBL2179766)
Show SMILES CC(C)Oc1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C26H28N2O3/c1-19(2)31-23-15-13-22(14-16-23)26(27-24(29)17-20-9-5-3-6-10-20)28-25(30)18-21-11-7-4-8-12-21/h3-16,19,26H,17-18H2,1-2H3,(H,27,29)(H,28,30)
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313n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399124
PNG
(CHEMBL2179737)
Show SMILES Cc1ccc(cc1)C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H22Cl2N2O2/c1-16-2-8-19(9-3-16)24(27-22(29)14-17-4-10-20(25)11-5-17)28-23(30)15-18-6-12-21(26)13-7-18/h2-13,24H,14-15H2,1H3,(H,27,29)(H,28,30)
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462n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399124
PNG
(CHEMBL2179737)
Show SMILES Cc1ccc(cc1)C(NC(=O)Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C24H22Cl2N2O2/c1-16-2-8-19(9-3-16)24(27-22(29)14-17-4-10-20(25)11-5-17)28-23(30)15-18-6-12-21(26)13-7-18/h2-13,24H,14-15H2,1H3,(H,27,29)(H,28,30)
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462n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399116
PNG
(CHEMBL2179762)
Show SMILES Cc1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C24H24N2O2/c1-18-12-14-21(15-13-18)24(25-22(27)16-19-8-4-2-5-9-19)26-23(28)17-20-10-6-3-7-11-20/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
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494n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399116
PNG
(CHEMBL2179762)
Show SMILES Cc1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C24H24N2O2/c1-18-12-14-21(15-13-18)24(25-22(27)16-19-8-4-2-5-9-19)26-23(28)17-20-10-6-3-7-11-20/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
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494n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399125
PNG
(CHEMBL2179755)
Show SMILES O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)c1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C28H31N3O2/c32-26(20-22-10-4-1-5-11-22)29-28(30-27(33)21-23-12-6-2-7-13-23)24-14-16-25(17-15-24)31-18-8-3-9-19-31/h1-2,4-7,10-17,28H,3,8-9,18-21H2,(H,29,32)(H,30,33)
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595n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399125
PNG
(CHEMBL2179755)
Show SMILES O=C(Cc1ccccc1)NC(NC(=O)Cc1ccccc1)c1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C28H31N3O2/c32-26(20-22-10-4-1-5-11-22)29-28(30-27(33)21-23-12-6-2-7-13-23)24-14-16-25(17-15-24)31-18-8-3-9-19-31/h1-2,4-7,10-17,28H,3,8-9,18-21H2,(H,29,32)(H,30,33)
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595n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399126
PNG
(CHEMBL2179768)
Show SMILES FC(F)(F)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C24H21F3N2O2/c25-24(26,27)20-13-11-19(12-14-20)23(28-21(30)15-17-7-3-1-4-8-17)29-22(31)16-18-9-5-2-6-10-18/h1-14,23H,15-16H2,(H,28,30)(H,29,31)
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596n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399126
PNG
(CHEMBL2179768)
Show SMILES FC(F)(F)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C24H21F3N2O2/c25-24(26,27)20-13-11-19(12-14-20)23(28-21(30)15-17-7-3-1-4-8-17)29-22(31)16-18-9-5-2-6-10-18/h1-14,23H,15-16H2,(H,28,30)(H,29,31)
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596n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399127
PNG
(CHEMBL2179726)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)c1ccccc1)NC(=O)c1ccccc1
Show InChI InChI=1S/C25H27N3O2/c1-3-28(4-2)22-17-15-19(16-18-22)23(26-24(29)20-11-7-5-8-12-20)27-25(30)21-13-9-6-10-14-21/h5-18,23H,3-4H2,1-2H3,(H,26,29)(H,27,30)
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688n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399127
PNG
(CHEMBL2179726)
Show SMILES CCN(CC)c1ccc(cc1)C(NC(=O)c1ccccc1)NC(=O)c1ccccc1
Show InChI InChI=1S/C25H27N3O2/c1-3-28(4-2)22-17-15-19(16-18-22)23(26-24(29)20-11-7-5-8-12-20)27-25(30)21-13-9-6-10-14-21/h5-18,23H,3-4H2,1-2H3,(H,26,29)(H,27,30)
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688n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399112
PNG
(CHEMBL2179776)
Show SMILES CN(C)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C25H27N3O2/c1-28(2)22-15-13-21(14-16-22)25(26-23(29)17-19-9-5-3-6-10-19)27-24(30)18-20-11-7-4-8-12-20/h3-16,25H,17-18H2,1-2H3,(H,26,29)(H,27,30)
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777n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399112
PNG
(CHEMBL2179776)
Show SMILES CN(C)c1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C25H27N3O2/c1-28(2)22-15-13-21(14-16-22)25(26-23(29)17-19-9-5-3-6-10-19)27-24(30)18-20-11-7-4-8-12-20/h3-16,25H,17-18H2,1-2H3,(H,26,29)(H,27,30)
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777n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399128
PNG
(CHEMBL2179764)
Show SMILES COc1ccc(cc1)C(NC(=O)Cc1ccccc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C24H24N2O3/c1-29-21-14-12-20(13-15-21)24(25-22(27)16-18-8-4-2-5-9-18)26-23(28)17-19-10-6-3-7-11-19/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
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783n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells incubated for 1 hr


J Med Chem 55: 9973-87 (2012)


Article DOI: 10.1021/jm301212u
BindingDB Entry DOI: 10.7270/Q22808R5
More data for this
Ligand-Target Pair
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