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PubMed code 22437111

Compile data set for download or QSAR
Found 34 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380851
PNG
(CHEMBL2018655)
Show SMILES COC(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C24H36N2O4/c1-24(2,23(29)30-3)25-21(27)19-15-18-13-9-4-5-10-14-20(18)26(22(19)28)16-17-11-7-6-8-12-17/h15,17H,4-14,16H2,1-3H3,(H,25,27)
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0.300n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380856
PNG
(CHEMBL2018660)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCOCCO
Show InChI InChI=1S/C27H43N3O5/c1-27(2,26(34)28-14-16-35-17-15-31)29-24(32)22-18-21-12-8-3-4-9-13-23(21)30(25(22)33)19-20-10-6-5-7-11-20/h18,20,31H,3-17,19H2,1-2H3,(H,28,34)(H,29,32)
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0.600n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380853
PNG
(CHEMBL2018657)
Show SMILES CN(CCO)C(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C26H41N3O4/c1-26(2,25(33)28(3)15-16-30)27-23(31)21-17-20-13-9-4-5-10-14-22(20)29(24(21)32)18-19-11-7-6-8-12-19/h17,19,30H,4-16,18H2,1-3H3,(H,27,31)
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0.600n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380854
PNG
(CHEMBL2018658)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCCO
Show InChI InChI=1S/C26H41N3O4/c1-26(2,25(33)27-15-10-16-30)28-23(31)21-17-20-13-8-3-4-9-14-22(20)29(24(21)32)18-19-11-6-5-7-12-19/h17,19,30H,3-16,18H2,1-2H3,(H,27,33)(H,28,31)
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1n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380861
PNG
(CHEMBL2018664)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(O)CC1
Show InChI InChI=1S/C28H43N3O4/c1-28(2,27(35)30-16-14-22(32)15-17-30)29-25(33)23-18-21-12-8-3-4-9-13-24(21)31(26(23)34)19-20-10-6-5-7-11-20/h18,20,22,32H,3-17,19H2,1-2H3,(H,29,33)
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1.10n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380855
PNG
(CHEMBL2018659)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCCCCO
Show InChI InChI=1S/C28H45N3O4/c1-28(2,27(35)29-17-11-6-12-18-32)30-25(33)23-19-22-15-9-3-4-10-16-24(22)31(26(23)34)20-21-13-7-5-8-14-21/h19,21,32H,3-18,20H2,1-2H3,(H,29,35)(H,30,33)
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1.20n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380851
PNG
(CHEMBL2018655)
Show SMILES COC(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C24H36N2O4/c1-24(2,23(29)30-3)25-21(27)19-15-18-13-9-4-5-10-14-20(18)26(22(19)28)16-17-11-7-6-8-12-17/h15,17H,4-14,16H2,1-3H3,(H,25,27)
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1.70n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380858
PNG
(CHEMBL2018662)
Show SMILES CC(=O)NCCNC(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C27H42N4O4/c1-19(32)28-15-16-29-26(35)27(2,3)30-24(33)22-17-21-13-9-4-5-10-14-23(21)31(25(22)34)18-20-11-7-6-8-12-20/h17,20H,4-16,18H2,1-3H3,(H,28,32)(H,29,35)(H,30,33)
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2.5n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380864
PNG
(CHEMBL2018780)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NN
Show InChI InChI=1S/C23H36N4O3/c1-23(2,22(30)26-24)25-20(28)18-14-17-12-8-3-4-9-13-19(17)27(21(18)29)15-16-10-6-5-7-11-16/h14,16H,3-13,15,24H2,1-2H3,(H,25,28)(H,26,30)
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2.80n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380853
PNG
(CHEMBL2018657)
Show SMILES CN(CCO)C(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C26H41N3O4/c1-26(2,25(33)28(3)15-16-30)27-23(31)21-17-20-13-9-4-5-10-14-22(20)29(24(21)32)18-19-11-7-6-8-12-19/h17,19,30H,4-16,18H2,1-3H3,(H,27,31)
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2.90n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380863
PNG
(CHEMBL2018666)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)C(N)=O
Show InChI InChI=1S/C29H44N4O4/c1-29(2,28(37)32-16-14-21(15-17-32)25(30)34)31-26(35)23-18-22-12-8-3-4-9-13-24(22)33(27(23)36)19-20-10-6-5-7-11-20/h18,20-21H,3-17,19H2,1-2H3,(H2,30,34)(H,31,35)
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3n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380856
PNG
(CHEMBL2018660)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCOCCO
Show InChI InChI=1S/C27H43N3O5/c1-27(2,26(34)28-14-16-35-17-15-31)29-24(32)22-18-21-12-8-3-4-9-13-23(21)30(25(22)33)19-20-10-6-5-7-11-20/h18,20,31H,3-17,19H2,1-2H3,(H,28,34)(H,29,32)
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3.40n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380849
PNG
(CHEMBL2018778)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)NS(C)(=O)=O
Show InChI InChI=1S/C29H46N4O5S/c1-29(2,28(36)32-17-15-23(16-18-32)31-39(3,37)38)30-26(34)24-19-22-13-9-4-5-10-14-25(22)33(27(24)35)20-21-11-7-6-8-12-21/h19,21,23,31H,4-18,20H2,1-3H3,(H,30,34)
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4.40n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380858
PNG
(CHEMBL2018662)
Show SMILES CC(=O)NCCNC(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C27H42N4O4/c1-19(32)28-15-16-29-26(35)27(2,3)30-24(33)22-17-21-13-9-4-5-10-14-23(21)31(25(22)34)18-20-11-7-6-8-12-20/h17,20H,4-16,18H2,1-3H3,(H,28,32)(H,29,35)(H,30,33)
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4.70n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380863
PNG
(CHEMBL2018666)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)C(N)=O
Show InChI InChI=1S/C29H44N4O4/c1-29(2,28(37)32-16-14-21(15-17-32)25(30)34)31-26(35)23-18-22-12-8-3-4-9-13-24(22)33(27(23)36)19-20-10-6-5-7-11-20/h18,20-21H,3-17,19H2,1-2H3,(H2,30,34)(H,31,35)
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4.90n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380855
PNG
(CHEMBL2018659)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCCCCO
Show InChI InChI=1S/C28H45N3O4/c1-28(2,27(35)29-17-11-6-12-18-32)30-25(33)23-19-22-15-9-3-4-10-16-24(22)31(26(23)34)20-21-13-7-5-8-14-21/h19,21,32H,3-18,20H2,1-2H3,(H,29,35)(H,30,33)
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5.80n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380860
PNG
(CHEMBL2016599)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCC(N)=O
Show InChI InChI=1S/C25H38N4O4/c1-25(2,24(33)27-15-21(26)30)28-22(31)19-14-18-12-8-3-4-9-13-20(18)29(23(19)32)16-17-10-6-5-7-11-17/h14,17H,3-13,15-16H2,1-2H3,(H2,26,30)(H,27,33)(H,28,31)
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6n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380854
PNG
(CHEMBL2018658)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCCO
Show InChI InChI=1S/C26H41N3O4/c1-26(2,25(33)27-15-10-16-30)28-23(31)21-17-20-13-8-3-4-9-14-22(20)29(24(21)32)18-19-11-6-5-7-12-19/h17,19,30H,3-16,18H2,1-2H3,(H,27,33)(H,28,31)
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6.30n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380865
PNG
(CHEMBL2018781)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NNS(C)(=O)=O
Show InChI InChI=1S/C24H38N4O5S/c1-24(2,23(31)26-27-34(3,32)33)25-21(29)19-15-18-13-9-4-5-10-14-20(18)28(22(19)30)16-17-11-7-6-8-12-17/h15,17,27H,4-14,16H2,1-3H3,(H,25,29)(H,26,31)
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7.30n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380861
PNG
(CHEMBL2018664)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(O)CC1
Show InChI InChI=1S/C28H43N3O4/c1-28(2,27(35)30-16-14-22(32)15-17-30)29-25(33)23-18-21-12-8-3-4-9-13-24(21)31(26(23)34)19-20-10-6-5-7-11-20/h18,20,22,32H,3-17,19H2,1-2H3,(H,29,33)
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8n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380860
PNG
(CHEMBL2016599)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCC(N)=O
Show InChI InChI=1S/C25H38N4O4/c1-25(2,24(33)27-15-21(26)30)28-22(31)19-14-18-12-8-3-4-9-13-20(18)29(23(19)32)16-17-10-6-5-7-11-17/h14,17H,3-13,15-16H2,1-2H3,(H2,26,30)(H,27,33)(H,28,31)
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11n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380864
PNG
(CHEMBL2018780)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NN
Show InChI InChI=1S/C23H36N4O3/c1-23(2,22(30)26-24)25-20(28)18-14-17-12-8-3-4-9-13-19(17)27(21(18)29)15-16-10-6-5-7-11-16/h14,16H,3-13,15,24H2,1-2H3,(H,25,28)(H,26,30)
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30n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380865
PNG
(CHEMBL2018781)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NNS(C)(=O)=O
Show InChI InChI=1S/C24H38N4O5S/c1-24(2,23(31)26-27-34(3,32)33)25-21(29)19-15-18-13-9-4-5-10-14-20(18)28(22(19)30)16-17-11-7-6-8-12-17/h15,17,27H,4-14,16H2,1-3H3,(H,25,29)(H,26,31)
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32n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380849
PNG
(CHEMBL2018778)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)NS(C)(=O)=O
Show InChI InChI=1S/C29H46N4O5S/c1-29(2,28(36)32-17-15-23(16-18-32)31-39(3,37)38)30-26(34)24-19-22-13-9-4-5-10-14-25(22)33(27(24)35)20-21-11-7-6-8-12-21/h19,21,23,31H,4-18,20H2,1-3H3,(H,30,34)
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39n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380857
PNG
(CHEMBL2018661)
Show SMILES CN(C)CCNC(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C27H44N4O3/c1-27(2,26(34)28-16-17-30(3)4)29-24(32)22-18-21-14-10-5-6-11-15-23(21)31(25(22)33)19-20-12-8-7-9-13-20/h18,20H,5-17,19H2,1-4H3,(H,28,34)(H,29,32)
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81n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380850
PNG
(CHEMBL2018779)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C30H46N4O6S/c1-30(2,29(38)33-17-15-22(16-18-33)26(35)32-41(3,39)40)31-27(36)24-19-23-13-9-4-5-10-14-25(23)34(28(24)37)20-21-11-7-6-8-12-21/h19,21-22H,4-18,20H2,1-3H3,(H,31,36)(H,32,35)
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128n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380850
PNG
(CHEMBL2018779)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C30H46N4O6S/c1-30(2,29(38)33-17-15-22(16-18-33)26(35)32-41(3,39)40)31-27(36)24-19-23-13-9-4-5-10-14-25(23)34(28(24)37)20-21-11-7-6-8-12-21/h19,21-22H,4-18,20H2,1-3H3,(H,31,36)(H,32,35)
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218n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380857
PNG
(CHEMBL2018661)
Show SMILES CN(C)CCNC(=O)C(C)(C)NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C27H44N4O3/c1-27(2,26(34)28-16-17-30(3)4)29-24(32)22-18-21-14-10-5-6-11-15-23(21)31(25(22)33)19-20-12-8-7-9-13-20/h18,20H,5-17,19H2,1-4H3,(H,28,34)(H,29,32)
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242n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380852
PNG
(CHEMBL2018656)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(O)=O
Show InChI InChI=1S/C23H34N2O4/c1-23(2,22(28)29)24-20(26)18-14-17-12-8-3-4-9-13-19(17)25(21(18)27)15-16-10-6-5-7-11-16/h14,16H,3-13,15H2,1-2H3,(H,24,26)(H,28,29)
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349n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380862
PNG
(CHEMBL2018665)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)C(O)=O
Show InChI InChI=1S/C29H43N3O5/c1-29(2,28(37)31-16-14-21(15-17-31)27(35)36)30-25(33)23-18-22-12-8-3-4-9-13-24(22)32(26(23)34)19-20-10-6-5-7-11-20/h18,20-21H,3-17,19H2,1-2H3,(H,30,33)(H,35,36)
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377n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380852
PNG
(CHEMBL2018656)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(O)=O
Show InChI InChI=1S/C23H34N2O4/c1-23(2,22(28)29)24-20(26)18-14-17-12-8-3-4-9-13-19(17)25(21(18)27)15-16-10-6-5-7-11-16/h14,16H,3-13,15H2,1-2H3,(H,24,26)(H,28,29)
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1.35E+3n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50380859
PNG
(CHEMBL2018663)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C25H37N3O5/c1-25(2,24(33)26-15-21(29)30)27-22(31)19-14-18-12-8-3-4-9-13-20(18)28(23(19)32)16-17-10-6-5-7-11-17/h14,17H,3-13,15-16H2,1-2H3,(H,26,33)(H,27,31)(H,29,30)
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2.82E+3n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380862
PNG
(CHEMBL2018665)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)N1CCC(CC1)C(O)=O
Show InChI InChI=1S/C29H43N3O5/c1-29(2,28(37)31-16-14-21(15-17-31)27(35)36)30-25(33)23-18-22-12-8-3-4-9-13-24(22)32(26(23)34)19-20-10-6-5-7-11-20/h18,20-21H,3-17,19H2,1-2H3,(H,30,33)(H,35,36)
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2.97E+3n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380859
PNG
(CHEMBL2018663)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C25H37N3O5/c1-25(2,24(33)26-15-21(29)30)27-22(31)19-14-18-12-8-3-4-9-13-20(18)28(23(19)32)16-17-10-6-5-7-11-17/h14,17H,3-13,15-16H2,1-2H3,(H,26,33)(H,27,31)(H,29,30)
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>5.00E+3n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%