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PubMed code 17004710

Compile data set for download or QSAR
Found 51 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


(MOUSE)		BDBM50195527
PNG
(CHEMBL387001 | N-cycloheptyl-1-(p-fluorobenzyl)-7-...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccc(F)cc1)cc(C(=O)NC1CCCCCC1)c2=O
Show InChI InChI=1S/C24H26FN3O2/c1-16-8-13-20-22(29)21(24(30)27-19-6-4-2-3-5-7-19)15-28(23(20)26-16)14-17-9-11-18(25)12-10-17/h8-13,15,19H,2-7,14H2,1H3,(H,27,30)
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 1n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195516
PNG
(CHEMBL216382 | N-(4'-methylcyclohexyl)-1-(p-fluoro...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(Cc2ccc(F)cc2)c2nc(C)ccc2c1=O |(20.1,4.38,;18.76,3.62,;18.75,2.08,;17.42,1.32,;16.08,2.1,;16.09,3.63,;17.43,4.39,;14.75,1.33,;13.42,2.1,;13.42,3.64,;12.08,1.34,;12.08,-.22,;10.73,-.99,;10.72,-2.53,;12.06,-3.3,;12.04,-4.84,;13.37,-5.61,;14.71,-4.85,;16.04,-5.62,;14.71,-3.3,;13.38,-2.53,;9.39,-.21,;8.06,-.98,;6.73,-.21,;5.39,-.98,;6.73,1.34,;8.06,2.11,;9.39,1.34,;10.73,2.12,;10.73,3.66,)|
Show InChI InChI=1S/C24H26FN3O2/c1-15-3-10-19(11-4-15)27-24(30)21-14-28(13-17-6-8-18(25)9-7-17)23-20(22(21)29)12-5-16(2)26-23/h5-9,12,14-15,19H,3-4,10-11,13H2,1-2H3,(H,27,30)
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 1.40n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195513
PNG
(CHEMBL217094 | N-cyclohexyl-7-chloro-1-(2-morpholi...)
Show SMILES Clc1ccc2c(c1)n(CCN1CCOCC1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C22H28ClN3O3/c23-16-6-7-18-20(14-16)26(9-8-25-10-12-29-13-11-25)15-19(21(18)27)22(28)24-17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,24,28)
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 3.30n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50072769
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid (2...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCCl
Show InChI InChI=1S/C22H36ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)24-21-20-23/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-21H2,1H3,(H,24,25)/b7-6-,10-9-,13-12-,16-15-
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PubMed
 3.90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195527
PNG
(CHEMBL387001 | N-cycloheptyl-1-(p-fluorobenzyl)-7-...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccc(F)cc1)cc(C(=O)NC1CCCCCC1)c2=O
Show InChI InChI=1S/C24H26FN3O2/c1-16-8-13-20-22(29)21(24(30)27-19-6-4-2-3-5-7-19)15-28(23(20)26-16)14-17-9-11-18(25)12-10-17/h8-13,15,19H,2-7,14H2,1H3,(H,27,30)
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 4.30n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195517
PNG
(CHEMBL385808 | N-cyclohexyl-1-benzylquinolin-4(1H)...)
Show SMILES O=C(NC1CCCCC1)c1cn(Cc2ccccc2)c2ccccc2c1=O
Show InChI InChI=1S/C23H24N2O2/c26-22-19-13-7-8-14-21(19)25(15-17-9-3-1-4-10-17)16-20(22)23(27)24-18-11-5-2-6-12-18/h1,3-4,7-10,13-14,16,18H,2,5-6,11-12,15H2,(H,24,27)
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 4.80n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195514
PNG
(CHEMBL217266 | N-cycloheptyl-1-benzyl-7-methyl-1,8...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccccc1)cc(C(=O)NC1CCCCCC1)c2=O
Show InChI InChI=1S/C24H27N3O2/c1-17-13-14-20-22(28)21(24(29)26-19-11-7-2-3-8-12-19)16-27(23(20)25-17)15-18-9-5-4-6-10-18/h4-6,9-10,13-14,16,19H,2-3,7-8,11-12,15H2,1H3,(H,26,29)
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 5.10n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195511
PNG
(CHEMBL217549 | N-(4'-methylcyclohexyl)-1-(o-fluoro...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(Cc2ccccc2F)c2nc(C)ccc2c1=O |(6.82,-7.93,;5.48,-8.69,;5.47,-10.23,;4.13,-10.99,;2.8,-10.21,;2.8,-8.67,;4.15,-7.91,;1.46,-10.97,;.13,-10.2,;.13,-8.66,;-1.21,-10.97,;-1.21,-12.52,;-2.56,-13.29,;-2.56,-14.83,;-1.23,-15.6,;-1.24,-17.14,;.08,-17.92,;1.42,-17.15,;1.42,-15.6,;.09,-14.84,;.09,-13.3,;-3.89,-12.52,;-5.22,-13.28,;-6.56,-12.51,;-7.89,-13.28,;-6.55,-10.97,;-5.23,-10.2,;-3.89,-10.96,;-2.55,-10.18,;-2.55,-8.64,)|
Show InChI InChI=1S/C24H26FN3O2/c1-15-7-10-18(11-8-15)27-24(30)20-14-28(13-17-5-3-4-6-21(17)25)23-19(22(20)29)12-9-16(2)26-23/h3-6,9,12,14-15,18H,7-8,10-11,13H2,1-2H3,(H,27,30)
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 8.40n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195516
PNG
(CHEMBL216382 | N-(4'-methylcyclohexyl)-1-(p-fluoro...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(Cc2ccc(F)cc2)c2nc(C)ccc2c1=O |(20.1,4.38,;18.76,3.62,;18.75,2.08,;17.42,1.32,;16.08,2.1,;16.09,3.63,;17.43,4.39,;14.75,1.33,;13.42,2.1,;13.42,3.64,;12.08,1.34,;12.08,-.22,;10.73,-.99,;10.72,-2.53,;12.06,-3.3,;12.04,-4.84,;13.37,-5.61,;14.71,-4.85,;16.04,-5.62,;14.71,-3.3,;13.38,-2.53,;9.39,-.21,;8.06,-.98,;6.73,-.21,;5.39,-.98,;6.73,1.34,;8.06,2.11,;9.39,1.34,;10.73,2.12,;10.73,3.66,)|
Show InChI InChI=1S/C24H26FN3O2/c1-15-3-10-19(11-4-15)27-24(30)21-14-28(13-17-6-8-18(25)9-7-17)23-20(22(21)29)12-5-16(2)26-23/h5-9,12,14-15,19H,3-4,10-11,13H2,1-2H3,(H,27,30)
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 8.70n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195519
PNG
(CHEMBL384595 | N-cyclohexyl-7-methyl-1-benzyl-1,8-...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C23H25N3O2/c1-16-12-13-19-21(27)20(23(28)25-18-10-6-3-7-11-18)15-26(22(19)24-16)14-17-8-4-2-5-9-17/h2,4-5,8-9,12-13,15,18H,3,6-7,10-11,14H2,1H3,(H,25,28)
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 10n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195529
PNG
(CHEMBL386489 | N-cyclohexyl-1-(p-fluorbenzyl)-1,8-...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NC3CCCCC3)c(=O)c3cccnc23)cc1
Show InChI InChI=1S/C22H22FN3O2/c23-16-10-8-15(9-11-16)13-26-14-19(20(27)18-7-4-12-24-21(18)26)22(28)25-17-5-2-1-3-6-17/h4,7-12,14,17H,1-3,5-6,13H2,(H,25,28)
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 13n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195518
PNG
(CHEMBL216057 | N-cycloheptyl-1-(o-fluorbenzyl)-7-m...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccccc1F)cc(C(=O)NC1CCCCCC1)c2=O
Show InChI InChI=1S/C24H26FN3O2/c1-16-12-13-19-22(29)20(24(30)27-18-9-4-2-3-5-10-18)15-28(23(19)26-16)14-17-8-6-7-11-21(17)25/h6-8,11-13,15,18H,2-5,9-10,14H2,1H3,(H,27,30)
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 13.4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195528
PNG
(CHEMBL218295 | N-cyclohexyl-7-methyl-1-phenethyl-1...)
Show SMILES Cc1ccc2c(n1)n(CCc1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C24H27N3O2/c1-17-12-13-20-22(28)21(24(29)26-19-10-6-3-7-11-19)16-27(23(20)25-17)15-14-18-8-4-2-5-9-18/h2,4-5,8-9,12-13,16,19H,3,6-7,10-11,14-15H2,1H3,(H,26,29)
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 16.3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195525
PNG
(CHEMBL216888 | N-cyclohexyl-7-chloro-1-(o-fluorben...)
Show SMILES Fc1ccccc1Cn1cc(C(=O)NC2CCCCC2)c(=O)c2ccc(Cl)nc12
Show InChI InChI=1S/C22H21ClFN3O2/c23-19-11-10-16-20(28)17(22(29)25-15-7-2-1-3-8-15)13-27(21(16)26-19)12-14-6-4-5-9-18(14)24/h4-6,9-11,13,15H,1-3,7-8,12H2,(H,25,29)
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 18.1n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195515
PNG
(CHEMBL217583 | N-cyclohexyl-7-chloro-1-(p-fluorben...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NC3CCCCC3)c(=O)c3ccc(Cl)nc23)cc1
Show InChI InChI=1S/C22H21ClFN3O2/c23-19-11-10-17-20(28)18(22(29)25-16-4-2-1-3-5-16)13-27(21(17)26-19)12-14-6-8-15(24)9-7-14/h6-11,13,16H,1-5,12H2,(H,25,29)
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 21.4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195522
PNG
(CHEMBL386725 | N-cyclohexyl-1-benzyl-7-chloro-1,8-...)
Show SMILES Clc1ccc2c(n1)n(Cc1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C22H22ClN3O2/c23-19-12-11-17-20(27)18(22(28)24-16-9-5-2-6-10-16)14-26(21(17)25-19)13-15-7-3-1-4-8-15/h1,3-4,7-8,11-12,14,16H,2,5-6,9-10,13H2,(H,24,28)
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 24.6n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195523
PNG
(CHEMBL216067 | N-cyclohexyl-7-methyl-1-(4-methoxyb...)
Show SMILES COc1ccc(Cn2cc(C(=O)NC3CCCCC3)c(=O)c3ccc(C)nc23)cc1
Show InChI InChI=1S/C24H27N3O3/c1-16-8-13-20-22(28)21(24(29)26-18-6-4-3-5-7-18)15-27(23(20)25-16)14-17-9-11-19(30-2)12-10-17/h8-13,15,18H,3-7,14H2,1-2H3,(H,26,29)
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 35.8n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195511
PNG
(CHEMBL217549 | N-(4'-methylcyclohexyl)-1-(o-fluoro...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(Cc2ccccc2F)c2nc(C)ccc2c1=O |(6.82,-7.93,;5.48,-8.69,;5.47,-10.23,;4.13,-10.99,;2.8,-10.21,;2.8,-8.67,;4.15,-7.91,;1.46,-10.97,;.13,-10.2,;.13,-8.66,;-1.21,-10.97,;-1.21,-12.52,;-2.56,-13.29,;-2.56,-14.83,;-1.23,-15.6,;-1.24,-17.14,;.08,-17.92,;1.42,-17.15,;1.42,-15.6,;.09,-14.84,;.09,-13.3,;-3.89,-12.52,;-5.22,-13.28,;-6.56,-12.51,;-7.89,-13.28,;-6.55,-10.97,;-5.23,-10.2,;-3.89,-10.96,;-2.55,-10.18,;-2.55,-8.64,)|
Show InChI InChI=1S/C24H26FN3O2/c1-15-7-10-18(11-8-15)27-24(30)20-14-28(13-17-5-3-4-6-21(17)25)23-19(22(20)29)12-9-16(2)26-23/h3-6,9,12,14-15,18H,7-8,10-11,13H2,1-2H3,(H,27,30)
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 37.5n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195524
PNG
(CHEMBL216438 | N-(4'-methylcyclohexyl)-7-chloro-1-...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(CCN2CCOCC2)c2nc(Cl)ccc2c1=O |(9.93,-29.26,;8.6,-30.03,;8.6,-31.57,;7.26,-32.34,;5.93,-31.57,;5.93,-30.03,;7.26,-29.26,;4.6,-32.34,;3.26,-31.57,;3.26,-30.03,;1.93,-32.34,;1.93,-33.88,;.59,-34.65,;.59,-36.19,;1.93,-36.96,;1.93,-38.5,;3.26,-39.27,;3.26,-40.81,;1.93,-41.58,;.59,-40.81,;.59,-39.27,;-.74,-33.88,;-2.07,-34.65,;-3.41,-33.88,;-4.75,-34.65,;-3.41,-32.34,;-2.07,-31.57,;-.74,-32.34,;.59,-31.57,;.59,-30.03,)|
Show InChI InChI=1S/C22H29ClN4O3/c1-15-2-4-16(5-3-15)24-22(29)18-14-27(9-8-26-10-12-30-13-11-26)21-17(20(18)28)6-7-19(23)25-21/h6-7,14-16H,2-5,8-13H2,1H3,(H,24,29)
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 40.5n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195520
PNG
(CHEMBL214511 | N-cyclohexyl-1-benzyl-1,8-naphthyri...)
Show SMILES O=C(NC1CCCCC1)c1cn(Cc2ccccc2)c2ncccc2c1=O
Show InChI InChI=1S/C22H23N3O2/c26-20-18-12-7-13-23-21(18)25(14-16-8-3-1-4-9-16)15-19(20)22(27)24-17-10-5-2-6-11-17/h1,3-4,7-9,12-13,15,17H,2,5-6,10-11,14H2,(H,24,27)
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 48.6n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195526
PNG
(CHEMBL385508 | N-cyclopentyl-7-methyl-1-(2-morphol...)
Show SMILES Cc1ccc2c(n1)n(CCN1CCOCC1)cc(C(=O)NC1CCCC1)c2=O
Show InChI InChI=1S/C21H28N4O3/c1-15-6-7-17-19(26)18(21(27)23-16-4-2-3-5-16)14-25(20(17)22-15)9-8-24-10-12-28-13-11-24/h6-7,14,16H,2-5,8-13H2,1H3,(H,23,27)
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 50n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50180036
PNG
((6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetra...)
Show SMILES CCCC(C)(C)c1ccc2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1 |r,c:13|
Show InChI InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h8-10,14,18-19H,7,11-13H2,1-6H3/t18-,19+/m0/s1
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 65n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195512
PNG
(CHEMBL214229 | N-cyclohexyl-1-(2-morpholin-4-yl-et...)
Show SMILES O=C(NC1CCCCC1)c1cn(CCN2CCOCC2)c2ncccc2c1=O
Show InChI InChI=1S/C21H28N4O3/c26-19-17-7-4-8-22-20(17)25(10-9-24-11-13-28-14-12-24)15-18(19)21(27)23-16-5-2-1-3-6-16/h4,7-8,15-16H,1-3,5-6,9-14H2,(H,23,27)
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 67.2n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50072769
PNG
((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid (2...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCCl
Show InChI InChI=1S/C22H36ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)24-21-20-23/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-21H2,1H3,(H,24,25)/b7-6-,10-9-,13-12-,16-15-
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 121n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195519
PNG
(CHEMBL384595 | N-cyclohexyl-7-methyl-1-benzyl-1,8-...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C23H25N3O2/c1-16-12-13-19-21(27)20(23(28)25-18-10-6-3-7-11-18)15-26(22(19)24-16)14-17-8-4-2-5-9-17/h2,4-5,8-9,12-13,15,18H,3,6-7,10-11,14H2,1H3,(H,25,28)
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 127n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195514
PNG
(CHEMBL217266 | N-cycloheptyl-1-benzyl-7-methyl-1,8...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccccc1)cc(C(=O)NC1CCCCCC1)c2=O
Show InChI InChI=1S/C24H27N3O2/c1-17-13-14-20-22(28)21(24(29)26-19-11-7-2-3-8-12-19)16-27(23(20)25-17)15-18-9-5-4-6-10-18/h4-6,9-10,13-14,16,19H,2-3,7-8,11-12,15H2,1H3,(H,26,29)
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 143n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195518
PNG
(CHEMBL216057 | N-cycloheptyl-1-(o-fluorbenzyl)-7-m...)
Show SMILES Cc1ccc2c(n1)n(Cc1ccccc1F)cc(C(=O)NC1CCCCCC1)c2=O
Show InChI InChI=1S/C24H26FN3O2/c1-16-12-13-19-22(29)20(24(30)27-18-9-4-2-3-5-10-18)15-28(23(19)26-16)14-17-8-6-7-11-21(17)25/h6-8,11-13,15,18H,2-5,9-10,14H2,1H3,(H,27,30)
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 149n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195525
PNG
(CHEMBL216888 | N-cyclohexyl-7-chloro-1-(o-fluorben...)
Show SMILES Fc1ccccc1Cn1cc(C(=O)NC2CCCCC2)c(=O)c2ccc(Cl)nc12
Show InChI InChI=1S/C22H21ClFN3O2/c23-19-11-10-16-20(28)17(22(29)25-15-7-2-1-3-8-15)13-27(21(16)26-19)12-14-6-4-5-9-18(14)24/h4-6,9-11,13,15H,1-3,7-8,12H2,(H,25,29)
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 171n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195529
PNG
(CHEMBL386489 | N-cyclohexyl-1-(p-fluorbenzyl)-1,8-...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NC3CCCCC3)c(=O)c3cccnc23)cc1
Show InChI InChI=1S/C22H22FN3O2/c23-16-10-8-15(9-11-16)13-26-14-19(20(27)18-7-4-12-24-21(18)26)22(28)25-17-5-2-1-3-6-17/h4,7-12,14,17H,1-3,5-6,13H2,(H,25,28)
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 384n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50180036
PNG
((6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetra...)
Show SMILES CCCC(C)(C)c1ccc2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1 |r,c:13|
Show InChI InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h8-10,14,18-19H,7,11-13H2,1-6H3/t18-,19+/m0/s1
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 458n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195522
PNG
(CHEMBL386725 | N-cyclohexyl-1-benzyl-7-chloro-1,8-...)
Show SMILES Clc1ccc2c(n1)n(Cc1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C22H22ClN3O2/c23-19-12-11-17-20(27)18(22(28)24-16-9-5-2-6-10-16)14-26(21(17)25-19)13-15-7-3-1-4-8-15/h1,3-4,7-8,11-12,14,16H,2,5-6,9-10,13H2,(H,24,28)
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 464n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195515
PNG
(CHEMBL217583 | N-cyclohexyl-7-chloro-1-(p-fluorben...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NC3CCCCC3)c(=O)c3ccc(Cl)nc23)cc1
Show InChI InChI=1S/C22H21ClFN3O2/c23-19-11-10-17-20(28)18(22(29)25-16-4-2-1-3-5-16)13-27(21(17)26-19)12-14-6-8-15(24)9-7-14/h6-11,13,16H,1-5,12H2,(H,25,29)
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 495n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195520
PNG
(CHEMBL214511 | N-cyclohexyl-1-benzyl-1,8-naphthyri...)
Show SMILES O=C(NC1CCCCC1)c1cn(Cc2ccccc2)c2ncccc2c1=O
Show InChI InChI=1S/C22H23N3O2/c26-20-18-12-7-13-23-21(18)25(14-16-8-3-1-4-9-16)15-19(20)22(27)24-17-10-5-2-6-11-17/h1,3-4,7-9,12-13,15,17H,2,5-6,10-11,14H2,(H,24,27)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195528
PNG
(CHEMBL218295 | N-cyclohexyl-7-methyl-1-phenethyl-1...)
Show SMILES Cc1ccc2c(n1)n(CCc1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C24H27N3O2/c1-17-12-13-20-22(28)21(24(29)26-19-10-6-3-7-11-19)16-27(23(20)25-17)15-14-18-8-4-2-5-9-18/h2,4-5,8-9,12-13,16,19H,3,6-7,10-11,14-15H2,1H3,(H,26,29)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195517
PNG
(CHEMBL385808 | N-cyclohexyl-1-benzylquinolin-4(1H)...)
Show SMILES O=C(NC1CCCCC1)c1cn(Cc2ccccc2)c2ccccc2c1=O
Show InChI InChI=1S/C23H24N2O2/c26-22-19-13-7-8-14-21(19)25(15-17-9-3-1-4-10-17)16-20(22)23(27)24-18-11-5-2-6-12-18/h1,3-4,7-10,13-14,16,18H,2,5-6,11-12,15H2,(H,24,27)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195509
PNG
(4-hydroxy-N-(4-methylcyclohexyl)-1-(2-morpholin-4-...)
Show SMILES CC1CCC(CC1)NC(=O)C1CN(CCN2CCOCC2)c2nc(C)ccc2C1O |(31.74,-6.21,;30.4,-6.98,;30.4,-8.52,;29.06,-9.29,;27.73,-8.52,;27.73,-6.98,;29.06,-6.21,;26.4,-9.29,;25.06,-8.52,;25.06,-6.98,;23.73,-9.29,;23.73,-10.83,;22.4,-11.61,;22.4,-13.15,;23.73,-13.91,;23.73,-15.46,;25.06,-16.23,;25.06,-17.77,;23.73,-18.54,;22.4,-17.77,;22.4,-16.23,;21.06,-10.83,;19.73,-11.61,;18.4,-10.83,;17.06,-11.61,;18.4,-9.29,;19.73,-8.52,;21.06,-9.29,;22.4,-8.52,;22.4,-6.98,)|
Show InChI InChI=1S/C23H36N4O3/c1-16-3-6-18(7-4-16)25-23(29)20-15-27(10-9-26-11-13-30-14-12-26)22-19(21(20)28)8-5-17(2)24-22/h5,8,16,18,20-21,28H,3-4,6-7,9-15H2,1-2H3,(H,25,29)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195526
PNG
(CHEMBL385508 | N-cyclopentyl-7-methyl-1-(2-morphol...)
Show SMILES Cc1ccc2c(n1)n(CCN1CCOCC1)cc(C(=O)NC1CCCC1)c2=O
Show InChI InChI=1S/C21H28N4O3/c1-15-6-7-17-19(26)18(21(27)23-16-4-2-3-5-16)14-25(20(17)22-15)9-8-24-10-12-28-13-11-24/h6-7,14,16H,2-5,8-13H2,1H3,(H,23,27)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195524
PNG
(CHEMBL216438 | N-(4'-methylcyclohexyl)-7-chloro-1-...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(CCN2CCOCC2)c2nc(Cl)ccc2c1=O |(9.93,-29.26,;8.6,-30.03,;8.6,-31.57,;7.26,-32.34,;5.93,-31.57,;5.93,-30.03,;7.26,-29.26,;4.6,-32.34,;3.26,-31.57,;3.26,-30.03,;1.93,-32.34,;1.93,-33.88,;.59,-34.65,;.59,-36.19,;1.93,-36.96,;1.93,-38.5,;3.26,-39.27,;3.26,-40.81,;1.93,-41.58,;.59,-40.81,;.59,-39.27,;-.74,-33.88,;-2.07,-34.65,;-3.41,-33.88,;-4.75,-34.65,;-3.41,-32.34,;-2.07,-31.57,;-.74,-32.34,;.59,-31.57,;.59,-30.03,)|
Show InChI InChI=1S/C22H29ClN4O3/c1-15-2-4-16(5-3-15)24-22(29)18-14-27(9-8-26-10-12-30-13-11-26)21-17(20(18)28)6-7-19(23)25-21/h6-7,14-16H,2-5,8-13H2,1H3,(H,24,29)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195508
PNG
(CHEMBL216555 | N-cyclohexyl-7-methyl-1-[2-(4-pheny...)
Show SMILES Cc1ccc2c(n1)n(CCN1CCN(CC1)c1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C28H35N5O2/c1-21-12-13-24-26(34)25(28(35)30-22-8-4-2-5-9-22)20-33(27(24)29-21)19-16-31-14-17-32(18-15-31)23-10-6-3-7-11-23/h3,6-7,10-13,20,22H,2,4-5,8-9,14-19H2,1H3,(H,30,35)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195508
PNG
(CHEMBL216555 | N-cyclohexyl-7-methyl-1-[2-(4-pheny...)
Show SMILES Cc1ccc2c(n1)n(CCN1CCN(CC1)c1ccccc1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C28H35N5O2/c1-21-12-13-24-26(34)25(28(35)30-22-8-4-2-5-9-22)20-33(27(24)29-21)19-16-31-14-17-32(18-15-31)23-10-6-3-7-11-23/h3,6-7,10-13,20,22H,2,4-5,8-9,14-19H2,1H3,(H,30,35)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195521
PNG
(CHEMBL216690 | N-cyclohexyl-1-benzyl-4-hydroxy-7-m...)
Show SMILES Cc1ccc2C(O)C(CN(Cc3ccccc3)c2n1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C23H29N3O2/c1-16-12-13-19-21(27)20(23(28)25-18-10-6-3-7-11-18)15-26(22(19)24-16)14-17-8-4-2-5-9-17/h2,4-5,8-9,12-13,18,20-21,27H,3,6-7,10-11,14-15H2,1H3,(H,25,28)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195512
PNG
(CHEMBL214229 | N-cyclohexyl-1-(2-morpholin-4-yl-et...)
Show SMILES O=C(NC1CCCCC1)c1cn(CCN2CCOCC2)c2ncccc2c1=O
Show InChI InChI=1S/C21H28N4O3/c26-19-17-7-4-8-22-20(17)25(10-9-24-11-13-28-14-12-24)15-18(19)21(27)23-16-5-2-1-3-6-16/h4,7-8,15-16H,1-3,5-6,9-14H2,(H,23,27)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195509
PNG
(4-hydroxy-N-(4-methylcyclohexyl)-1-(2-morpholin-4-...)
Show SMILES CC1CCC(CC1)NC(=O)C1CN(CCN2CCOCC2)c2nc(C)ccc2C1O |(31.74,-6.21,;30.4,-6.98,;30.4,-8.52,;29.06,-9.29,;27.73,-8.52,;27.73,-6.98,;29.06,-6.21,;26.4,-9.29,;25.06,-8.52,;25.06,-6.98,;23.73,-9.29,;23.73,-10.83,;22.4,-11.61,;22.4,-13.15,;23.73,-13.91,;23.73,-15.46,;25.06,-16.23,;25.06,-17.77,;23.73,-18.54,;22.4,-17.77,;22.4,-16.23,;21.06,-10.83,;19.73,-11.61,;18.4,-10.83,;17.06,-11.61,;18.4,-9.29,;19.73,-8.52,;21.06,-9.29,;22.4,-8.52,;22.4,-6.98,)|
Show InChI InChI=1S/C23H36N4O3/c1-16-3-6-18(7-4-16)25-23(29)20-15-27(10-9-26-11-13-30-14-12-26)22-19(21(20)28)8-5-17(2)24-22/h5,8,16,18,20-21,28H,3-4,6-7,9-15H2,1-2H3,(H,25,29)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195523
PNG
(CHEMBL216067 | N-cyclohexyl-7-methyl-1-(4-methoxyb...)
Show SMILES COc1ccc(Cn2cc(C(=O)NC3CCCCC3)c(=O)c3ccc(C)nc23)cc1
Show InChI InChI=1S/C24H27N3O3/c1-16-8-13-20-22(28)21(24(29)26-18-6-4-3-5-7-18)15-27(23(20)25-16)14-17-9-11-19(30-2)12-10-17/h8-13,15,18H,3-7,14H2,1-2H3,(H,26,29)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195521
PNG
(CHEMBL216690 | N-cyclohexyl-1-benzyl-4-hydroxy-7-m...)
Show SMILES Cc1ccc2C(O)C(CN(Cc3ccccc3)c2n1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C23H29N3O2/c1-16-12-13-19-21(27)20(23(28)25-18-10-6-3-7-11-18)15-26(22(19)24-16)14-17-8-4-2-5-9-17/h2,4-5,8-9,12-13,18,20-21,27H,3,6-7,10-11,14-15H2,1H3,(H,25,28)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195513
PNG
(CHEMBL217094 | N-cyclohexyl-7-chloro-1-(2-morpholi...)
Show SMILES Clc1ccc2c(c1)n(CCN1CCOCC1)cc(C(=O)NC1CCCCC1)c2=O
Show InChI InChI=1S/C22H28ClN3O3/c23-16-6-7-18-20(14-16)26(9-8-25-10-12-29-13-11-25)15-19(21(18)27)22(28)24-17-4-2-1-3-5-17/h6-7,14-15,17H,1-5,8-13H2,(H,24,28)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195510
PNG
(CHEMBL385057 | N-cyclohexyl-1-(o-fluorbenzyl)-4-hy...)
Show SMILES Cc1ccc2C(O)C(CN(Cc3ccccc3F)c2n1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C23H28FN3O2/c1-15-11-12-18-21(28)19(23(29)26-17-8-3-2-4-9-17)14-27(22(18)25-15)13-16-7-5-6-10-20(16)24/h5-7,10-12,17,19,21,28H,2-4,8-9,13-14H2,1H3,(H,26,29)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)		BDBM50195510
PNG
(CHEMBL385057 | N-cyclohexyl-1-(o-fluorbenzyl)-4-hy...)
Show SMILES Cc1ccc2C(O)C(CN(Cc3ccccc3F)c2n1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C23H28FN3O2/c1-15-11-12-18-21(28)19(23(29)26-17-8-3-2-4-9-17)14-27(22(18)25-15)13-16-7-5-6-10-20(16)24/h5-7,10-12,17,19,21,28H,2-4,8-9,13-14H2,1H3,(H,26,29)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB2 receptor in DBA/J2 mouse spleen

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM21281
PNG
((11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-(naphth...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23 |r|
Show InChI InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1
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n/an/an/an/a 204n/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Activity at CB1 receptor assessed as stimulation of [35S]GTP-gamma-S binding in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195511
PNG
(CHEMBL217549 | N-(4'-methylcyclohexyl)-1-(o-fluoro...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(Cc2ccccc2F)c2nc(C)ccc2c1=O |(6.82,-7.93,;5.48,-8.69,;5.47,-10.23,;4.13,-10.99,;2.8,-10.21,;2.8,-8.67,;4.15,-7.91,;1.46,-10.97,;.13,-10.2,;.13,-8.66,;-1.21,-10.97,;-1.21,-12.52,;-2.56,-13.29,;-2.56,-14.83,;-1.23,-15.6,;-1.24,-17.14,;.08,-17.92,;1.42,-17.15,;1.42,-15.6,;.09,-14.84,;.09,-13.3,;-3.89,-12.52,;-5.22,-13.28,;-6.56,-12.51,;-7.89,-13.28,;-6.55,-10.97,;-5.23,-10.2,;-3.89,-10.96,;-2.55,-10.18,;-2.55,-8.64,)|
Show InChI InChI=1S/C24H26FN3O2/c1-15-7-10-18(11-8-15)27-24(30)20-14-28(13-17-5-3-4-6-21(17)25)23-19(22(20)29)12-9-16(2)26-23/h3-6,9,12,14-15,18H,7-8,10-11,13H2,1-2H3,(H,27,30)
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n/an/an/an/a 138n/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Activity at CB1 receptor assessed as stimulation of [35S]GTP-gamma-S binding in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))		BDBM50195516
PNG
(CHEMBL216382 | N-(4'-methylcyclohexyl)-1-(p-fluoro...)
Show SMILES CC1CCC(CC1)NC(=O)c1cn(Cc2ccc(F)cc2)c2nc(C)ccc2c1=O |(20.1,4.38,;18.76,3.62,;18.75,2.08,;17.42,1.32,;16.08,2.1,;16.09,3.63,;17.43,4.39,;14.75,1.33,;13.42,2.1,;13.42,3.64,;12.08,1.34,;12.08,-.22,;10.73,-.99,;10.72,-2.53,;12.06,-3.3,;12.04,-4.84,;13.37,-5.61,;14.71,-4.85,;16.04,-5.62,;14.71,-3.3,;13.38,-2.53,;9.39,-.21,;8.06,-.98,;6.73,-.21,;5.39,-.98,;6.73,1.34,;8.06,2.11,;9.39,1.34,;10.73,2.12,;10.73,3.66,)|
Show InChI InChI=1S/C24H26FN3O2/c1-15-3-10-19(11-4-15)27-24(30)21-14-28(13-17-6-8-18(25)9-7-17)23-20(22(21)29)12-5-16(2)26-23/h5-9,12,14-15,19H,3-4,10-11,13H2,1-2H3,(H,27,30)
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n/an/an/an/a 27n/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Activity at CB1 receptor assessed as stimulation of [35S]GTP-gamma-S binding in DBA/J2 mouse brain

J Med Chem 49: 5947-57 (2006)


Article DOI: 10.1021/jm0603466
BindingDB Entry DOI: 10.7270/Q2DB82N5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%