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PubMed code 21996466

Compile data set for download or QSAR
Found 40 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))
BDBM50356552
PNG
(CHEMBL1909860)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H24Cl2N4O/c1-2-17-20(21(29)25-15-8-4-3-5-9-15)26-28(22(17)27-12-6-7-13-27)16-10-11-18(23)19(24)14-16/h6-7,10-15H,2-5,8-9H2,1H3,(H,25,29)
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0.510n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356548
PNG
(CHEMBL1909856)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H21Cl3N4O/c1-13-19(20(29)25-14-6-3-2-4-7-14)26-28(15-9-10-16(22)17(23)12-15)21(13)27-11-5-8-18(27)24/h5,8-12,14H,2-4,6-7H2,1H3,(H,25,29)
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0.900n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356550
PNG
(CHEMBL1909858)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H20Cl4N4O/c1-12-19(20(30)26-13-5-3-2-4-6-13)27-29(14-7-8-15(22)16(23)11-14)21(12)28-17(24)9-10-18(28)25/h7-11,13H,2-6H2,1H3,(H,26,30)
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1.30n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356554
PNG
(CHEMBL1909957)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H28Cl2N4O/c1-4-19-22(23(31)27-17-8-6-5-7-9-17)28-30(18-12-13-20(25)21(26)14-18)24(19)29-15(2)10-11-16(29)3/h10-14,17H,4-9H2,1-3H3,(H,27,31)
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1.70n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356540
PNG
(CHEMBL1909848)
Show SMILES Cc1c(nn(c1-n1cc2CCCCc2c1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C25H28Cl2N4O/c1-16-23(24(32)28-20-9-3-2-4-10-20)29-31(22-12-11-19(26)13-21(22)27)25(16)30-14-17-7-5-6-8-18(17)15-30/h11-15,20H,2-10H2,1H3,(H,28,32)
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2.30n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356542
PNG
(CHEMBL1909850)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H24Cl2N4O/c1-2-17-20(21(29)25-16-8-4-3-5-9-16)26-28(22(17)27-12-6-7-13-27)19-11-10-15(23)14-18(19)24/h6-7,10-14,16H,2-5,8-9H2,1H3,(H,25,29)
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3n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356550
PNG
(CHEMBL1909858)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H20Cl4N4O/c1-12-19(20(30)26-13-5-3-2-4-6-13)27-29(14-7-8-15(22)16(23)11-14)21(12)28-17(24)9-10-18(28)25/h7-11,13H,2-6H2,1H3,(H,26,30)
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5.60n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356544
PNG
(CHEMBL1909852)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H28Cl2N4O/c1-4-19-22(23(31)27-18-8-6-5-7-9-18)28-30(21-13-12-17(25)14-20(21)26)24(19)29-15(2)10-11-16(29)3/h10-14,18H,4-9H2,1-3H3,(H,27,31)
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6.70n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356536
PNG
(CHEMBL1909844)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H21Cl3N4O/c1-13-19(20(29)25-15-6-3-2-4-7-15)26-28(17-10-9-14(22)12-16(17)23)21(13)27-11-5-8-18(27)24/h5,8-12,15H,2-4,6-7H2,1H3,(H,25,29)
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7.70n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356548
PNG
(CHEMBL1909856)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H21Cl3N4O/c1-13-19(20(29)25-14-6-3-2-4-7-14)26-28(15-9-10-16(22)17(23)12-15)21(13)27-11-5-8-18(27)24/h5,8-12,14H,2-4,6-7H2,1H3,(H,25,29)
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8.60n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356538
PNG
(CHEMBL1909846)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H20Cl4N4O/c1-12-19(20(30)26-14-5-3-2-4-6-14)27-29(16-8-7-13(22)11-15(16)23)21(12)28-17(24)9-10-18(28)25/h7-11,14H,2-6H2,1H3,(H,26,30)
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9.40n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356552
PNG
(CHEMBL1909860)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H24Cl2N4O/c1-2-17-20(21(29)25-15-8-4-3-5-9-15)26-28(22(17)27-12-6-7-13-27)16-10-11-18(23)19(24)14-16/h6-7,10-15H,2-5,8-9H2,1H3,(H,25,29)
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15.3n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356542
PNG
(CHEMBL1909850)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H24Cl2N4O/c1-2-17-20(21(29)25-16-8-4-3-5-9-16)26-28(22(17)27-12-6-7-13-27)19-11-10-15(23)14-18(19)24/h6-7,10-14,16H,2-5,8-9H2,1H3,(H,25,29)
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15.8n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356536
PNG
(CHEMBL1909844)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H21Cl3N4O/c1-13-19(20(29)25-15-6-3-2-4-7-15)26-28(17-10-9-14(22)12-16(17)23)21(13)27-11-5-8-18(27)24/h5,8-12,15H,2-4,6-7H2,1H3,(H,25,29)
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18.3n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356538
PNG
(CHEMBL1909846)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H20Cl4N4O/c1-12-19(20(30)26-14-5-3-2-4-6-14)27-29(16-8-7-13(22)11-15(16)23)21(12)28-17(24)9-10-18(28)25/h7-11,14H,2-6H2,1H3,(H,26,30)
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19.1n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356535
PNG
(CHEMBL1909843)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H15Cl5N4O/c1-12-20(21(32)28-11-13-4-6-15(24)16(25)9-13)29-31(18-7-5-14(23)10-17(18)26)22(12)30-8-2-3-19(30)27/h2-10H,11H2,1H3,(H,28,32)
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25.2n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356551
PNG
(CHEMBL1909859)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C23H18Cl4N4O/c1-2-16-21(22(32)28-13-14-5-7-17(24)19(26)11-14)29-31(23(16)30-9-3-4-10-30)15-6-8-18(25)20(27)12-15/h3-12H,2,13H2,1H3,(H,28,32)
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29.6n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356539
PNG
(CHEMBL1909847)
Show SMILES Cc1c(nn(c1-n1cc2CCCCc2c1)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C26H22Cl4N4O/c1-15-24(25(35)31-12-16-6-8-20(28)21(29)10-16)32-34(23-9-7-19(27)11-22(23)30)26(15)33-13-17-4-2-3-5-18(17)14-33/h6-11,13-14H,2-5,12H2,1H3,(H,31,35)
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45.9n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356554
PNG
(CHEMBL1909957)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H28Cl2N4O/c1-4-19-22(23(31)27-17-8-6-5-7-9-17)28-30(18-12-13-20(25)21(26)14-18)24(19)29-15(2)10-11-16(29)3/h10-14,17H,4-9H2,1-3H3,(H,27,31)
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48n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356541
PNG
(CHEMBL1909849)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C23H18Cl4N4O/c1-2-16-21(22(32)28-13-14-5-7-17(25)18(26)11-14)29-31(23(16)30-9-3-4-10-30)20-8-6-15(24)12-19(20)27/h3-12H,2,13H2,1H3,(H,28,32)
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48.7n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356543
PNG
(CHEMBL1909851)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C25H22Cl4N4O/c1-4-18-23(24(34)30-13-16-7-9-19(27)20(28)11-16)31-33(22-10-8-17(26)12-21(22)29)25(18)32-14(2)5-6-15(32)3/h5-12H,4,13H2,1-3H3,(H,30,34)
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53.1n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356547
PNG
(CHEMBL1909855)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H15Cl5N4O/c1-12-20(21(32)28-11-13-4-6-15(23)17(25)9-13)29-31(14-5-7-16(24)18(26)10-14)22(12)30-8-2-3-19(30)27/h2-10H,11H2,1H3,(H,28,32)
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53.9n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356549
PNG
(CHEMBL1909857)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H14Cl6N4O/c1-11-20(21(33)29-10-12-2-4-14(23)16(25)8-12)30-32(13-3-5-15(24)17(26)9-13)22(11)31-18(27)6-7-19(31)28/h2-9H,10H2,1H3,(H,29,33)
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55.6n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356543
PNG
(CHEMBL1909851)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C25H22Cl4N4O/c1-4-18-23(24(34)30-13-16-7-9-19(27)20(28)11-16)31-33(22-10-8-17(26)12-21(22)29)25(18)32-14(2)5-6-15(32)3/h5-12H,4,13H2,1-3H3,(H,30,34)
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56.1n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356537
PNG
(CHEMBL1909845)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H14Cl6N4O/c1-11-20(21(33)29-10-12-2-4-14(24)15(25)8-12)30-32(17-5-3-13(23)9-16(17)26)22(11)31-18(27)6-7-19(31)28/h2-9H,10H2,1H3,(H,29,33)
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66.1n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356539
PNG
(CHEMBL1909847)
Show SMILES Cc1c(nn(c1-n1cc2CCCCc2c1)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C26H22Cl4N4O/c1-15-24(25(35)31-12-16-6-8-20(28)21(29)10-16)32-34(23-9-7-19(27)11-22(23)30)26(15)33-13-17-4-2-3-5-18(17)14-33/h6-11,13-14H,2-5,12H2,1H3,(H,31,35)
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72.9n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356547
PNG
(CHEMBL1909855)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H15Cl5N4O/c1-12-20(21(32)28-11-13-4-6-15(23)17(25)9-13)29-31(14-5-7-16(24)18(26)10-14)22(12)30-8-2-3-19(30)27/h2-10H,11H2,1H3,(H,28,32)
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74.1n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356535
PNG
(CHEMBL1909843)
Show SMILES Cc1c(nn(c1-n1cccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H15Cl5N4O/c1-12-20(21(32)28-11-13-4-6-15(24)16(25)9-13)29-31(18-7-5-14(23)10-17(18)26)22(12)30-8-2-3-19(30)27/h2-10H,11H2,1H3,(H,28,32)
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98.5n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356553
PNG
(CHEMBL1909861)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C25H22Cl4N4O/c1-4-18-23(24(34)30-13-16-7-9-19(26)21(28)11-16)31-33(17-8-10-20(27)22(29)12-17)25(18)32-14(2)5-6-15(32)3/h5-12H,4,13H2,1-3H3,(H,30,34)
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114n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356537
PNG
(CHEMBL1909845)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H14Cl6N4O/c1-11-20(21(33)29-10-12-2-4-14(24)15(25)8-12)30-32(17-5-3-13(23)9-16(17)26)22(11)31-18(27)6-7-19(31)28/h2-9H,10H2,1H3,(H,29,33)
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135n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356546
PNG
(CHEMBL1909854)
Show SMILES CCc1ccc(CC)n1-c1c(C)c(nn1-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C25H30Cl2N4O/c1-4-18-11-12-19(5-2)30(18)25-16(3)23(24(32)28-17-9-7-6-8-10-17)29-31(25)20-13-14-21(26)22(27)15-20/h11-15,17H,4-10H2,1-3H3,(H,28,32)
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136n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356549
PNG
(CHEMBL1909857)
Show SMILES Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H14Cl6N4O/c1-11-20(21(33)29-10-12-2-4-14(23)16(25)8-12)30-32(13-3-5-15(24)17(26)9-13)22(11)31-18(27)6-7-19(31)28/h2-9H,10H2,1H3,(H,29,33)
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162n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356540
PNG
(CHEMBL1909848)
Show SMILES Cc1c(nn(c1-n1cc2CCCCc2c1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C25H28Cl2N4O/c1-16-23(24(32)28-20-9-3-2-4-10-20)29-31(22-12-11-19(26)13-21(22)27)25(16)30-14-17-7-5-6-8-18(17)15-30/h11-15,20H,2-10H2,1H3,(H,28,32)
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376n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356546
PNG
(CHEMBL1909854)
Show SMILES CCc1ccc(CC)n1-c1c(C)c(nn1-c1ccc(Cl)c(Cl)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C25H30Cl2N4O/c1-4-18-11-12-19(5-2)30(18)25-16(3)23(24(32)28-17-9-7-6-8-10-17)29-31(25)20-13-14-21(26)22(27)15-20/h11-15,17H,4-10H2,1-3H3,(H,28,32)
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410n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356551
PNG
(CHEMBL1909859)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C23H18Cl4N4O/c1-2-16-21(22(32)28-13-14-5-7-17(24)19(26)11-14)29-31(23(16)30-9-3-4-10-30)15-6-8-18(25)20(27)12-15/h3-12H,2,13H2,1H3,(H,28,32)
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454n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356541
PNG
(CHEMBL1909849)
Show SMILES CCc1c(nn(c1-n1cccc1)-c1ccc(Cl)cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C23H18Cl4N4O/c1-2-16-21(22(32)28-13-14-5-7-17(25)18(26)11-14)29-31(23(16)30-9-3-4-10-30)20-8-6-15(24)12-19(20)27/h3-12H,2,13H2,1H3,(H,28,32)
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455n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356544
PNG
(CHEMBL1909852)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H28Cl2N4O/c1-4-19-22(23(31)27-18-8-6-5-7-9-18)28-30(21-13-12-17(25)14-20(21)26)24(19)29-15(2)10-11-16(29)3/h10-14,18H,4-9H2,1-3H3,(H,27,31)
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754n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356553
PNG
(CHEMBL1909861)
Show SMILES CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C25H22Cl4N4O/c1-4-18-23(24(34)30-13-16-7-9-19(26)21(28)11-16)31-33(17-8-10-20(27)22(29)12-17)25(18)32-14(2)5-6-15(32)3/h5-12H,4,13H2,1-3H3,(H,30,34)
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966n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50356545
PNG
(CHEMBL1909853)
Show SMILES CCc1ccc(CC)n1-c1c(C)c(nn1-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C26H24Cl4N4O/c1-4-17-7-8-18(5-2)33(17)26-15(3)24(32-34(26)19-9-11-21(28)23(30)13-19)25(35)31-14-16-6-10-20(27)22(29)12-16/h6-13H,4-5,14H2,1-3H3,(H,31,35)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB2 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50356545
PNG
(CHEMBL1909853)
Show SMILES CCc1ccc(CC)n1-c1c(C)c(nn1-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C26H24Cl4N4O/c1-4-17-7-8-18(5-2)33(17)26-15(3)24(32-34(26)19-9-11-21(28)23(30)13-19)25(35)31-14-16-6-10-20(27)22(29)12-16/h6-13H,4-5,14H2,1-3H3,(H,31,35)
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UniChem

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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor expressed in HEK cells


Eur J Med Chem 46: 5641-53 (2011)


Article DOI: 10.1016/j.ejmech.2011.09.037
BindingDB Entry DOI: 10.7270/Q2P55NXD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%