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Compile Data Set for Download or QSAR

Found 95 hits with Last Name = 'hoogendoorn' and Initial = 'j'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312822
PNG
((R)-1-(4-chlorophenyl)-N-methyl-5-phenyl-N'-(4-(tr...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)C1=NN([C@H](C1)c1ccccc1)c1ccc(Cl)cc1 |r,w:3.3,t:18|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-17(12-14-31)23(25,26)27)20-15-21(16-5-3-2-4-6-16)32(29-20)19-9-7-18(24)8-10-19/h2-10,17,21H,11-15H2,1H3,(H,28,30)/t21-/m1/s1
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2n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312833
PNG
((S)-3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(4-(tr...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,w:3.3,c:21|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-18(12-14-31)23(25,26)27)32-15-20(16-5-3-2-4-6-16)21(29-32)17-7-9-19(24)10-8-17/h2-10,18,20H,11-15H2,1H3,(H,28,30)/t20-/m1/s1
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4.70n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312831
PNG
(3-(4-chlorophenyl)-N'-(4-fluoropiperidin-1-ylsulfo...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)CC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:18|
Show InChI InChI=1S/C22H25ClFN5O2S/c1-25-22(27-32(30,31)28-13-11-19(24)12-14-28)29-15-20(16-5-3-2-4-6-16)21(26-29)17-7-9-18(23)10-8-17/h2-10,19-20H,11-15H2,1H3,(H,25,27)
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7.5n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312821
PNG
((S)-1-(4-chlorophenyl)-N-methyl-5-phenyl-N'-(4-(tr...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)C1=NN([C@@H](C1)c1ccccc1)c1ccc(Cl)cc1 |r,w:3.3,t:18|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-17(12-14-31)23(25,26)27)20-15-21(16-5-3-2-4-6-16)32(29-20)19-9-7-18(24)8-10-19/h2-10,17,21H,11-15H2,1H3,(H,28,30)/t21-/m0/s1
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7.60n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50230537
PNG
((S)-3-(4-chlorophenyl)-N'-(4-chlorophenylsulfonyl)...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-11-19(25)12-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H,26,28)/t21-/m1/s1
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7.80n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312820
PNG
((R)-1-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)C1=NN([C@H](C1)c1ccccc1)c1ccc(Cl)cc1 |r,w:3.3,t:16|
Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)19-15-20(16-5-3-2-4-6-16)30(27-19)18-9-7-17(23)8-10-18/h2-10,20H,11-15H2,1H3,(H,26,28)/t20-/m1/s1
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9.20n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312828
PNG
(1-(2,4-dichlorophenyl)-N-methyl-5-phenyl-N'-(4-(tr...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(cc1)C(F)(F)F)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1Cl |w:1.0,t:18|
Show InChI InChI=1S/C24H19Cl2F3N4O2S/c1-30-23(32-36(34,35)18-10-7-16(8-11-18)24(27,28)29)20-14-22(15-5-3-2-4-6-15)33(31-20)21-12-9-17(25)13-19(21)26/h2-13,22H,14H2,1H3,(H,30,32)
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11.3n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50300458
PNG
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)
Show SMILES CN=C(NS(=O)(=O)N1CCC(F)(F)CC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19|
Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)30-15-19(16-5-3-2-4-6-16)20(27-30)17-7-9-18(23)10-8-17/h2-10,19H,11-15H2,1H3,(H,26,28)
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12.2n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138899
PNG
(3-Chloro-N-[1-[3-(4-chloro-phenyl)-4-phenyl-4,5-di...)
Show SMILES CN=C(NS(=O)(=O)c1cccc(Cl)c1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-9-5-8-19(25)14-20)29-15-21(16-6-3-2-4-7-16)22(27-29)17-10-12-18(24)13-11-17/h2-14,21H,15H2,1H3,(H,26,28)
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13.9n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312832
PNG
(3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(4-(triflu...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:21|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-18(12-14-31)23(25,26)27)32-15-20(16-5-3-2-4-6-16)21(29-32)17-7-9-19(24)10-8-17/h2-10,18,20H,11-15H2,1H3,(H,28,30)
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14.5n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138902
PNG
(CHEMBL160767 | N-[1-Amino-1-[3-(4-chloro-phenyl)-4...)
Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=N)NS(=O)(=O)c1ccc(Cl)cc1 |t:8|
Show InChI InChI=1S/C22H18Cl2N4O2S/c23-17-8-6-16(7-9-17)21-20(15-4-2-1-3-5-15)14-28(26-21)22(25)27-31(29,30)19-12-10-18(24)11-13-19/h1-13,20H,14H2,(H2,25,27)
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16.1n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138903
PNG
(CHEMBL350924 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES CSC(=NS(=O)(=O)c1ccc(cc1)C(F)(F)F)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:21|
Show InChI InChI=1S/C24H19ClF3N3O2S2/c1-34-23(30-35(32,33)20-13-9-18(10-14-20)24(26,27)28)31-15-21(16-5-3-2-4-6-16)22(29-31)17-7-11-19(25)12-8-17/h2-14,21H,15H2,1H3
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16.6n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312825
PNG
(1-(4-chlorophenyl)-N'-(4-fluorophenylsulfonyl)-N-m...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(F)cc1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1 |w:1.0,t:15|
Show InChI InChI=1S/C23H20ClFN4O2S/c1-26-23(28-32(30,31)20-13-9-18(25)10-14-20)21-15-22(16-5-3-2-4-6-16)29(27-21)19-11-7-17(24)8-12-19/h2-14,22H,15H2,1H3,(H,26,28)
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21.7n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138897
PNG
(CHEMBL351123 | Naphthalene-2-sulfonic acid 1-[3-(4...)
Show SMILES CN=C(NS(=O)(=O)c1ccc2ccccc2c1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:22|
Show InChI InChI=1S/C27H23ClN4O2S/c1-29-27(31-35(33,34)24-16-13-19-7-5-6-10-22(19)17-24)32-18-25(20-8-3-2-4-9-20)26(30-32)21-11-14-23(28)15-12-21/h2-17,25H,18H2,1H3,(H,29,31)
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21.8n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138921
PNG
(CHEMBL158138 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)NC(=NC)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:13.14,c:19|
Show InChI InChI=1S/C24H23ClN4O3S/c1-26-24(28-33(30,31)21-14-12-20(32-2)13-15-21)29-16-22(17-6-4-3-5-7-17)23(27-29)18-8-10-19(25)11-9-18/h3-15,22H,16H2,1-2H3,(H,26,28)
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22.9n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138912
PNG
(CHEMBL156556 | N-[1-Amino-1-[3-(4-chloro-phenyl)-4...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(=N)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:19|
Show InChI InChI=1S/C25H25ClN4O2S/c1-16-13-17(2)24(18(3)14-16)33(31,32)29-25(27)30-15-22(19-7-5-4-6-8-19)23(28-30)20-9-11-21(26)12-10-20/h4-14,22H,15H2,1-3H3,(H2,27,29)
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24.2n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


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



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM29094
PNG
((+/-)-SLV319 | (S)-3-(4-chlorophenyl)-N-(4-chlorop...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-11-19(25)12-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H,26,28)
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25n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM29094
PNG
((+/-)-SLV319 | (S)-3-(4-chlorophenyl)-N-(4-chlorop...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-11-19(25)12-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H,26,28)
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25.2n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138915
PNG
(CHEMBL156264 | N-[1-[(S)-3-(4-Chloro-phenyl)-4-phe...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(cc1)C(F)(F)F)N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:21|
Show InChI InChI=1S/C24H20ClF3N4O2S/c1-29-23(31-35(33,34)20-13-9-18(10-14-20)24(26,27)28)32-15-21(16-5-3-2-4-6-16)22(30-32)17-7-11-19(25)12-8-17/h2-14,21H,15H2,1H3,(H,29,31)/t21-/m1/s1
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35.9n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138900
PNG
(CHEMBL157591 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES CN=C(NS(=O)(=O)c1cccc(c1)C(F)(F)F)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:21|
Show InChI InChI=1S/C24H20ClF3N4O2S/c1-29-23(31-35(33,34)20-9-5-8-18(14-20)24(26,27)28)32-15-21(16-6-3-2-4-7-16)22(30-32)17-10-12-19(25)13-11-17/h2-14,21H,15H2,1H3,(H,29,31)
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36.5n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312827
PNG
(CHEMBL1081305 | N'-(4-chlorophenylsulfonyl)-1-(2,4...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1Cl |w:1.0,t:15|
Show InChI InChI=1S/C23H19Cl3N4O2S/c1-27-23(29-33(31,32)18-10-7-16(24)8-11-18)20-14-22(15-5-3-2-4-6-15)30(28-20)21-12-9-17(25)13-19(21)26/h2-13,22H,14H2,1H3,(H,27,29)
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37n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312819
PNG
((S)-1-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)C1=NN([C@@H](C1)c1ccccc1)c1ccc(Cl)cc1 |r,w:3.3,t:16|
Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)19-15-20(16-5-3-2-4-6-16)30(27-19)18-9-7-17(23)8-10-18/h2-10,20H,11-15H2,1H3,(H,26,28)/t20-/m0/s1
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38.8n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312835
PNG
((S)-3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,w:3.3,c:19|
Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)30-15-19(16-5-3-2-4-6-16)20(27-30)17-7-9-18(23)10-8-17/h2-10,19H,11-15H2,1H3,(H,26,28)/t19-/m1/s1
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42n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138919
PNG
(CHEMBL158502 | N-[1-Amino-1-[3-(4-chloro-phenyl)-4...)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC(=N)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:17|
Show InChI InChI=1S/C22H18ClFN4O2S/c23-17-8-6-16(7-9-17)21-20(15-4-2-1-3-5-15)14-28(26-21)22(25)27-31(29,30)19-12-10-18(24)11-13-19/h1-13,20H,14H2,(H2,25,27)
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52.6n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312826
PNG
(CHEMBL1081304 | N'-(3-chlorophenylsulfonyl)-1-(2,4...)
Show SMILES CN=C(NS(=O)(=O)c1cccc(Cl)c1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1Cl |w:1.0,t:15|
Show InChI InChI=1S/C23H19Cl3N4O2S/c1-27-23(29-33(31,32)18-9-5-8-16(24)12-18)20-14-22(15-6-3-2-4-7-15)30(28-20)21-11-10-17(25)13-19(21)26/h2-13,22H,14H2,1H3,(H,27,29)
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53n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138918
PNG
(CHEMBL348174 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES CN=C(NS(=O)(=O)c1c(C)cc(C)cc1C)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:20|
Show InChI InChI=1S/C26H27ClN4O2S/c1-17-14-18(2)25(19(3)15-17)34(32,33)30-26(28-4)31-16-23(20-8-6-5-7-9-20)24(29-31)21-10-12-22(27)13-11-21/h5-15,23H,16H2,1-4H3,(H,28,30)
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54.2n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312830
PNG
(1-(4-chlorophenyl)-N'-(4-fluoropiperidin-1-ylsulfo...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)CC1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1 |w:3.3,t:15|
Show InChI InChI=1S/C22H25ClFN5O2S/c1-25-22(27-32(30,31)28-13-11-18(24)12-14-28)20-15-21(16-5-3-2-4-6-16)29(26-20)19-9-7-17(23)8-10-19/h2-10,18,21H,11-15H2,1H3,(H,25,27)
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55n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312821
PNG
((S)-1-(4-chlorophenyl)-N-methyl-5-phenyl-N'-(4-(tr...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)C1=NN([C@@H](C1)c1ccccc1)c1ccc(Cl)cc1 |r,w:3.3,t:18|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-17(12-14-31)23(25,26)27)20-15-21(16-5-3-2-4-6-16)32(29-20)19-9-7-18(24)8-10-19/h2-10,17,21H,11-15H2,1H3,(H,28,30)/t21-/m0/s1
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58n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312823
PNG
((S)-3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(piper...)
Show SMILES CNC(=NS(=O)(=O)N1CCCCC1)N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,w:3.3,c:17|
Show InChI InChI=1S/C22H26ClN5O2S/c1-24-22(26-31(29,30)27-14-6-3-7-15-27)28-16-20(17-8-4-2-5-9-17)21(25-28)18-10-12-19(23)13-11-18/h2,4-5,8-13,20H,3,6-7,14-16H2,1H3,(H,24,26)/t20-/m1/s1
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58n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138923
PNG
(4-Chloro-N-[1-[3-(4-chloro-phenyl)-4-phenyl-4,5-di...)
Show SMILES C\N=C(/NC(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:17|
Show InChI InChI=1S/C24H20Cl2N4O/c1-27-24(28-23(31)18-9-13-20(26)14-10-18)30-15-21(16-5-3-2-4-6-16)22(29-30)17-7-11-19(25)12-8-17/h2-14,21H,15H2,1H3,(H,27,28,31)
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70.6n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138909
PNG
(2-Chloro-N-[1-[3-(4-chloro-phenyl)-4-phenyl-4,5-di...)
Show SMILES CN=C(NS(=O)(=O)c1ccccc1Cl)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)21-10-6-5-9-20(21)25)29-15-19(16-7-3-2-4-8-16)22(27-29)17-11-13-18(24)14-12-17/h2-14,19H,15H2,1H3,(H,26,28)
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75.4n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312824
PNG
(1-(4-chlorophenyl)-N'-(4-chlorophenylsulfonyl)-N-m...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1 |w:1.0,t:15|
Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-9-18(25)10-14-20)21-15-22(16-5-3-2-4-6-16)29(27-21)19-11-7-17(24)8-12-19/h2-14,22H,15H2,1H3,(H,26,28)
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84n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138901
PNG
(CHEMBL349771 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(C)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C24H23ClN4O2S/c1-17-8-14-21(15-9-17)32(30,31)28-24(26-2)29-16-22(18-6-4-3-5-7-18)23(27-29)19-10-12-20(25)13-11-19/h3-15,22H,16H2,1-2H3,(H,26,28)
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119n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312834
PNG
((R)-3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(4-(tr...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)N1C[C@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,w:3.3,c:21|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-18(12-14-31)23(25,26)27)32-15-20(16-5-3-2-4-6-16)21(29-32)17-7-9-19(24)10-8-17/h2-10,18,20H,11-15H2,1H3,(H,28,30)/t20-/m0/s1
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140n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312829
PNG
(1-(4-chlorophenyl)-N-methyl-5-phenyl-N'-(piperidin...)
Show SMILES CNC(=NS(=O)(=O)N1CCCCC1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1 |w:3.3,t:14|
Show InChI InChI=1S/C22H26ClN5O2S/c1-24-22(26-31(29,30)27-14-6-3-7-15-27)20-16-21(17-8-4-2-5-9-17)28(25-20)19-12-10-18(23)11-13-19/h2,4-5,8-13,21H,3,6-7,14-16H2,1H3,(H,24,26)
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141n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50172898
PNG
(3,4-diarylpyrazoline derivative | 3-(4-chloropheny...)
Show SMILES CN=C(NS(=O)(=O)N1CCCCC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:17|
Show InChI InChI=1S/C22H26ClN5O2S/c1-24-22(26-31(29,30)27-14-6-3-7-15-27)28-16-20(17-8-4-2-5-9-17)21(25-28)18-10-12-19(23)13-11-18/h2,4-5,8-13,20H,3,6-7,14-16H2,1H3,(H,24,26)
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152n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138911
PNG
(CHEMBL158779 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES CN=C(NS(=O)(=O)c1ccccc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:17|
Show InChI InChI=1S/C23H21ClN4O2S/c1-25-23(27-31(29,30)20-10-6-3-7-11-20)28-16-21(17-8-4-2-5-9-17)22(26-28)18-12-14-19(24)15-13-18/h2-15,21H,16H2,1H3,(H,25,27)
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170n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50312828
PNG
(1-(2,4-dichlorophenyl)-N-methyl-5-phenyl-N'-(4-(tr...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(cc1)C(F)(F)F)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1Cl |w:1.0,t:18|
Show InChI InChI=1S/C24H19Cl2F3N4O2S/c1-30-23(32-36(34,35)18-10-7-16(8-11-18)24(27,28)29)20-14-22(15-5-3-2-4-6-15)33(31-20)21-12-9-17(25)13-19(21)26/h2-13,22H,14H2,1H3,(H,30,32)
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179n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138904
PNG
(CHEMBL158610 | N-[1-Amino-1-[3-(4-chloro-phenyl)-4...)
Show SMILES COc1ccc(cc1)S(=O)(=O)NC(=N)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:18|
Show InChI InChI=1S/C23H21ClN4O3S/c1-31-19-11-13-20(14-12-19)32(29,30)27-23(25)28-15-21(16-5-3-2-4-6-16)22(26-28)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H2,25,27)
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196n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138895
PNG
(CHEMBL158935 | N-[1-Amino-1-[3-(4-chloro-phenyl)-4...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=N)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:17|
Show InChI InChI=1S/C23H21ClN4O2S/c1-16-7-13-20(14-8-16)31(29,30)27-23(25)28-15-21(17-5-3-2-4-6-17)22(26-28)18-9-11-19(24)12-10-18/h2-14,21H,15H2,1H3,(H2,25,27)
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197n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138916
PNG
(4-Chloro-N-[1-[3-(4-fluoro-phenyl)-4-phenyl-4,5-di...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(F)cc1)c1ccccc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H20ClFN4O2S/c1-26-23(28-32(30,31)20-13-9-18(24)10-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-11-19(25)12-8-17/h2-14,21H,15H2,1H3,(H,26,28)
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214n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50300458
PNG
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)
Show SMILES CN=C(NS(=O)(=O)N1CCC(F)(F)CC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19|
Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)30-15-19(16-5-3-2-4-6-16)20(27-30)17-7-9-18(23)10-8-17/h2-10,19H,11-15H2,1H3,(H,26,28)
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219n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138907
PNG
(CHEMBL345466 | N-[1-[3-(4-Chloro-phenyl)-4-phenyl-...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(cc1)C(F)(F)F)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:21|
Show InChI InChI=1S/C24H20ClF3N4O2S/c1-29-23(31-35(33,34)20-13-9-18(10-14-20)24(26,27)28)32-15-21(16-5-3-2-4-6-16)22(30-32)17-7-11-19(25)12-8-17/h2-14,21H,15H2,1H3,(H,29,31)
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221n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50312827
PNG
(CHEMBL1081305 | N'-(4-chlorophenylsulfonyl)-1-(2,4...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1Cl |w:1.0,t:15|
Show InChI InChI=1S/C23H19Cl3N4O2S/c1-27-23(29-33(31,32)18-10-7-16(24)8-11-18)20-14-22(15-5-3-2-4-6-15)30(28-20)21-12-9-17(25)13-19(21)26/h2-13,22H,14H2,1H3,(H,27,29)
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248n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138910
PNG
(CHEMBL158837 | N-[1-[3,4-Bis-(4-chloro-phenyl)-4,5...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |w:1.0,c:18|
Show InChI InChI=1S/C23H19Cl3N4O2S/c1-27-23(29-33(31,32)20-12-10-19(26)11-13-20)30-14-21(15-2-6-17(24)7-3-15)22(28-30)16-4-8-18(25)9-5-16/h2-13,21H,14H2,1H3,(H,27,29)
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255n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138906
PNG
(4-Chloro-N-[1-[3-(4-chloro-phenyl)-4-phenyl-4,5-di...)
Show SMILES CN(C)C(=NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:4.4,c:19|
Show InChI InChI=1S/C24H22Cl2N4O2S/c1-29(2)24(28-33(31,32)21-14-12-20(26)13-15-21)30-16-22(17-6-4-3-5-7-17)23(27-30)18-8-10-19(25)11-9-18/h3-15,22H,16H2,1-2H3
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280n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312819
PNG
((S)-1-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)C1=NN([C@@H](C1)c1ccccc1)c1ccc(Cl)cc1 |r,w:3.3,t:16|
Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)19-15-20(16-5-3-2-4-6-16)30(27-19)18-9-7-17(23)8-10-18/h2-10,20H,11-15H2,1H3,(H,26,28)/t20-/m0/s1
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280n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50138896
PNG
(CHEMBL157149 | N-[1-[(R)-3-(4-Chloro-phenyl)-4-phe...)
Show SMILES CN=C(NS(=O)(=O)c1ccc(cc1)C(F)(F)F)N1C[C@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:21|
Show InChI InChI=1S/C24H20ClF3N4O2S/c1-29-23(31-35(33,34)20-13-9-18(10-14-20)24(26,27)28)32-15-21(16-5-3-2-4-6-16)22(30-32)17-7-11-19(25)12-8-17/h2-14,21H,15H2,1H3,(H,29,31)/t21-/m0/s1
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293n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells


J Med Chem 47: 627-43 (2004)


Article DOI: 10.1021/jm031019q
BindingDB Entry DOI: 10.7270/Q2610ZQT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50312833
PNG
((S)-3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(4-(tr...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(CC1)C(F)(F)F)N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,w:3.3,c:21|
Show InChI InChI=1S/C23H25ClF3N5O2S/c1-28-22(30-35(33,34)31-13-11-18(12-14-31)23(25,26)27)32-15-20(16-5-3-2-4-6-16)21(29-32)17-7-9-19(24)10-8-17/h2-10,18,20H,11-15H2,1H3,(H,28,30)/t20-/m1/s1
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305n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
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