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PubMed code 21923175

Compile data set for download or QSAR
Found 29 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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50419282
PNG
(CHEMBL1835119)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C25H32N4O2/c1-19(2)15-29-24(30)18-28(25(29)31)16-20-9-11-21(12-10-20)23-8-6-7-22(26-23)17-27-13-4-3-5-14-27/h6-12,18-19,30H,3-5,13-17H2,1-2H3
PDB
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PubMed
3.16E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-dofetilide from human ERG channel expressed in HEK293 by scintillation counting


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419307
PNG
(CHEMBL1835124)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c(=O)n1C1CC1
Show InChI InChI=1S/C24H28N4O2/c29-23-17-27(24(30)28(23)21-11-12-21)15-18-7-9-19(10-8-18)22-6-4-5-20(25-22)16-26-13-2-1-3-14-26/h4-10,17,21,29H,1-3,11-16H2
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n/an/an/an/a 31.6n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419293
PNG
(CHEMBL1835134)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c(=O)n1CC1CCC1
Show InChI InChI=1S/C26H31FN4O2/c27-22-11-12-23(28-24(22)17-29-13-2-1-3-14-29)21-9-7-20(8-10-21)15-30-18-25(32)31(26(30)33)16-19-5-4-6-19/h7-12,18-19,32H,1-6,13-17H2
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n/an/an/an/a 2.51n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419295
PNG
(CHEMBL1835132)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c(=O)n1C1CC1
Show InChI InChI=1S/C24H27FN4O2/c25-20-10-11-21(26-22(20)15-27-12-2-1-3-13-27)18-6-4-17(5-7-18)14-28-16-23(30)29(24(28)31)19-8-9-19/h4-7,10-11,16,19,30H,1-3,8-9,12-15H2
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n/an/an/an/a 10n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419300
PNG
(CHEMBL1835126)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c(=O)n1CC1CC1
Show InChI InChI=1S/C25H30N4O2/c30-24-18-28(25(31)29(24)16-20-7-8-20)15-19-9-11-21(12-10-19)23-6-4-5-22(26-23)17-27-13-2-1-3-14-27/h4-6,9-12,18,20,30H,1-3,7-8,13-17H2
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n/an/an/an/a 3.16n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419303
PNG
(CHEMBL1835122)
Show SMILES Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C22H26N4O2/c1-24-21(27)16-26(22(24)28)14-17-8-10-18(11-9-17)20-7-5-6-19(23-20)15-25-12-3-2-4-13-25/h5-11,16,27H,2-4,12-15H2,1H3
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n/an/an/an/a 39.8n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419281
PNG
(CHEMBL1835136)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCC(C)C3)n2)c1=O
Show InChI InChI=1S/C26H34N4O2/c1-19(2)14-30-25(31)18-29(26(30)32)16-21-9-11-22(12-10-21)24-8-4-7-23(27-24)17-28-13-5-6-20(3)15-28/h4,7-12,18-20,31H,5-6,13-17H2,1-3H3
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n/an/an/an/a 12.6n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419287
PNG
(CHEMBL1835217)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCC(F)(F)C3)n2)c1=O
Show InChI InChI=1S/C25H30F2N4O2/c1-18(2)13-31-23(32)16-30(24(31)33)14-19-7-9-20(10-8-19)22-6-3-5-21(28-22)15-29-12-4-11-25(26,27)17-29/h3,5-10,16,18,32H,4,11-15,17H2,1-2H3
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n/an/an/an/a 2n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419302
PNG
(CHEMBL1835123)
Show SMILES CC(C)n1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C24H30N4O2/c1-18(2)28-23(29)17-27(24(28)30)15-19-9-11-20(12-10-19)22-8-6-7-21(25-22)16-26-13-4-3-5-14-26/h6-12,17-18,29H,3-5,13-16H2,1-2H3
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n/an/an/an/a 12.6n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419306
PNG
(CHEMBL1835218)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCC(F)(F)C3)n2)c1=O
Show InChI InChI=1S/C25H29F3N4O2/c1-17(2)12-32-23(33)15-31(24(32)34)13-18-4-6-19(7-5-18)21-9-8-20(26)22(29-21)14-30-11-3-10-25(27,28)16-30/h4-9,15,17,33H,3,10-14,16H2,1-2H3
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n/an/an/an/a 0.501n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419308
PNG
(CHEMBL1835127)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c(=O)n1CC(F)F
Show InChI InChI=1S/C23H26F2N4O2/c24-21(25)15-29-22(30)16-28(23(29)31)13-17-7-9-18(10-8-17)20-6-4-5-19(26-20)14-27-11-2-1-3-12-27/h4-10,16,21,30H,1-3,11-15H2
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n/an/an/an/a 25.1n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419288
PNG
(CHEMBL1835216)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCOCC3)n2)c1=O
Show InChI InChI=1S/C24H29FN4O3/c1-17(2)13-29-23(30)16-28(24(29)31)14-18-3-5-19(6-4-18)21-8-7-20(25)22(26-21)15-27-9-11-32-12-10-27/h3-8,16-17,30H,9-15H2,1-2H3
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n/an/an/an/a 7.94n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419282
PNG
(CHEMBL1835119)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C25H32N4O2/c1-19(2)15-29-24(30)18-28(25(29)31)16-20-9-11-21(12-10-20)23-8-6-7-22(26-23)17-27-13-4-3-5-14-27/h6-12,18-19,30H,3-5,13-17H2,1-2H3
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n/an/an/an/a 2.51n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419283
PNG
(CHEMBL1835222)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCS(=O)(=O)CC3)n2)c(=O)n1C1CC1
Show InChI InChI=1S/C23H25FN4O4S/c24-19-7-8-20(25-21(19)14-26-9-11-33(31,32)12-10-26)17-3-1-16(2-4-17)13-27-15-22(29)28(23(27)30)18-5-6-18/h1-4,7-8,15,18,29H,5-6,9-14H2
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n/an/an/an/a 10n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419284
PNG
(CHEMBL1835221)
Show SMILES CCn1c(O)cn(Cc2ccc(cc2)-c2cccc(CC3CCCCC3)n2)c1=O
Show InChI InChI=1S/C24H29N3O2/c1-2-27-23(28)17-26(24(27)29)16-19-11-13-20(14-12-19)22-10-6-9-21(25-22)15-18-7-4-3-5-8-18/h6,9-14,17-18,28H,2-5,7-8,15-16H2,1H3
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n/an/an/an/a 19.9n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419285
PNG
(CHEMBL1835220)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCS(=O)(=O)CC3)n2)c1=O
Show InChI InChI=1S/C24H29FN4O4S/c1-17(2)13-29-23(30)16-28(24(29)31)14-18-3-5-19(6-4-18)21-8-7-20(25)22(26-21)15-27-9-11-34(32,33)12-10-27/h3-8,16-17,30H,9-15H2,1-2H3
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n/an/an/an/a 2.51n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419291
PNG
(CHEMBL1835213)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCC(C)C3)n2)c1=O
Show InChI InChI=1S/C26H33FN4O2/c1-18(2)13-31-25(32)17-30(26(31)33)15-20-6-8-21(9-7-20)23-11-10-22(27)24(28-23)16-29-12-4-5-19(3)14-29/h6-11,17-19,32H,4-5,12-16H2,1-3H3
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n/an/an/an/a 2.51n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419294
PNG
(CHEMBL1835133)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c(=O)n1CC1CC1
Show InChI InChI=1S/C25H29FN4O2/c26-21-10-11-22(27-23(21)16-28-12-2-1-3-13-28)20-8-6-18(7-9-20)14-29-17-24(31)30(25(29)32)15-19-4-5-19/h6-11,17,19,31H,1-5,12-16H2
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n/an/an/an/a 2n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419296
PNG
(CHEMBL1835131)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C25H31FN4O2/c1-18(2)14-30-24(31)17-29(25(30)32)15-19-6-8-20(9-7-19)22-11-10-21(26)23(27-22)16-28-12-4-3-5-13-28/h6-11,17-18,31H,3-5,12-16H2,1-2H3
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n/an/an/an/a 2.51n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419301
PNG
(CHEMBL1835125)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c(=O)n1C1CCC1
Show InChI InChI=1S/C25H30N4O2/c30-24-18-28(25(31)29(24)22-7-5-8-22)16-19-10-12-20(13-11-19)23-9-4-6-21(26-23)17-27-14-2-1-3-15-27/h4,6,9-13,18,22,30H,1-3,5,7-8,14-17H2
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n/an/an/an/a 3.98n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419299
PNG
(CHEMBL1835128)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c(=O)n1CC(F)(F)F
Show InChI InChI=1S/C23H25F3N4O2/c24-23(25,26)16-30-21(31)15-29(22(30)32)13-17-7-9-18(10-8-17)20-6-4-5-19(27-20)14-28-11-2-1-3-12-28/h4-10,15,31H,1-3,11-14,16H2
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n/an/an/an/a 3.16n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419292
PNG
(CHEMBL1835135)
Show SMILES Oc1cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c(=O)n1CC(F)F
Show InChI InChI=1S/C23H25F3N4O2/c24-18-8-9-19(27-20(18)13-28-10-2-1-3-11-28)17-6-4-16(5-7-17)12-29-15-22(31)30(23(29)32)14-21(25)26/h4-9,15,21,31H,1-3,10-14H2
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n/an/an/an/a 2.51n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419304
PNG
(CHEMBL1835121)
Show SMILES CCn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C23H28N4O2/c1-2-27-22(28)17-26(23(27)29)15-18-9-11-19(12-10-18)21-8-6-7-20(24-21)16-25-13-4-3-5-14-25/h6-12,17,28H,2-5,13-16H2,1H3
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n/an/an/an/a 10n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419289
PNG
(CHEMBL1835215)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCC(F)C3)n2)c1=O
Show InChI InChI=1S/C25H30F2N4O2/c1-17(2)12-31-24(32)16-30(25(31)33)13-18-5-7-19(8-6-18)22-10-9-21(27)23(28-22)15-29-11-3-4-20(26)14-29/h5-10,16-17,20,32H,3-4,11-15H2,1-2H3
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n/an/an/an/a 0.398n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419297
PNG
(CHEMBL1835130)
Show SMILES CCCn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C24H29FN4O2/c1-2-12-29-23(30)17-28(24(29)31)15-18-6-8-19(9-7-18)21-11-10-20(25)22(26-21)16-27-13-4-3-5-14-27/h6-11,17,30H,2-5,12-16H2,1H3
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n/an/an/an/a 0.794n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419298
PNG
(CHEMBL1835129)
Show SMILES CCn1c(O)cn(Cc2ccc(cc2)-c2ccc(F)c(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C23H27FN4O2/c1-2-28-22(29)16-27(23(28)30)14-17-6-8-18(9-7-17)20-11-10-19(24)21(25-20)15-26-12-4-3-5-13-26/h6-11,16,29H,2-5,12-15H2,1H3
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n/an/an/an/a 1.58n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419305
PNG
(CHEMBL1835120)
Show SMILES CCCn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCCC3)n2)c1=O
Show InChI InChI=1S/C24H30N4O2/c1-2-13-28-23(29)18-27(24(28)30)16-19-9-11-20(12-10-19)22-8-6-7-21(25-22)17-26-14-4-3-5-15-26/h6-12,18,29H,2-5,13-17H2,1H3
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n/an/an/an/a 1.26n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419286
PNG
(CHEMBL1835219)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCS(=O)(=O)CC3)n2)c1=O
Show InChI InChI=1S/C24H30N4O4S/c1-18(2)14-28-23(29)17-27(24(28)30)15-19-6-8-20(9-7-19)22-5-3-4-21(25-22)16-26-10-12-33(31,32)13-11-26/h3-9,17-18,29H,10-16H2,1-2H3
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PubMed
n/an/an/an/a 25.1n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50419290
PNG
(CHEMBL1835214)
Show SMILES CC(C)Cn1c(O)cn(Cc2ccc(cc2)-c2cccc(CN3CCCC(F)C3)n2)c1=O
Show InChI InChI=1S/C25H31FN4O2/c1-18(2)13-30-24(31)17-29(25(30)32)14-19-8-10-20(11-9-19)23-7-3-6-22(27-23)16-28-12-4-5-21(26)15-28/h3,6-11,17-18,21,31H,4-5,12-16H2,1-2H3
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n/an/an/an/a 0.398n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP formation after 45 mins by...


J Med Chem 54: 7350-62 (2011)


Article DOI: 10.1021/jm200916p
BindingDB Entry DOI: 10.7270/Q2J38TTB
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%