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PubMed code 23406429

Compile data set for download or QSAR
Found 83 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))
BDBM50427413
PNG
(CHEMBL2326297)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C25H30N2O3S/c1-5-26(6-2)22-13-9-21(10-14-22)19-27(23-11-7-20(3)8-12-23)31(28,29)25-17-15-24(30-4)16-18-25/h7-18H,5-6,19H2,1-4H3
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0.5n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50180022
PNG
(5-(4-chloro-3-methyl-phenyl)-1-(4-methyl-benzyl)-1...)
Show SMILES Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2C3(C)CCC(C3)C2(C)C)cc1 |THB:21:22:26.25:28|
Show InChI InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)
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2.10n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427420
PNG
(CHEMBL2326290)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2cccc(C)c2)cc1
Show InChI InChI=1S/C24H27ClN2O2S/c1-4-26(5-2)22-13-9-20(10-14-22)18-27(23-15-11-21(25)12-16-23)30(28,29)24-8-6-7-19(3)17-24/h6-17H,4-5,18H2,1-3H3
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2.80n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427414
PNG
(CHEMBL2326296)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O2S/c1-4-26(5-2)22-14-8-20(9-15-22)18-27(23-12-6-19(3)7-13-23)30(28,29)24-16-10-21(25)11-17-24/h6-17H,4-5,18H2,1-3H3
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3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427416
PNG
(CHEMBL2326294)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C24H28N2O2S/c1-4-25(5-2)22-17-13-21(14-18-22)19-26(23-15-11-20(3)12-16-23)29(27,28)24-9-7-6-8-10-24/h6-18H,4-5,19H2,1-3H3
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3.40n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427410
PNG
(CHEMBL2326300)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(cc2)C(C)C)cc1
Show InChI InChI=1S/C27H34N2O2S/c1-6-28(7-2)25-16-10-23(11-17-25)20-29(26-14-8-22(5)9-15-26)32(30,31)27-18-12-24(13-19-27)21(3)4/h8-19,21H,6-7,20H2,1-5H3
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4.30n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427412
PNG
(CHEMBL2326298)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C25H30N2O2S/c1-5-26(6-2)23-15-11-22(12-16-23)19-27(24-13-7-20(3)8-14-24)30(28,29)25-17-9-21(4)10-18-25/h7-18H,5-6,19H2,1-4H3
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5.40n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427415
PNG
(CHEMBL2326295)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C24H27FN2O2S/c1-4-26(5-2)22-14-8-20(9-15-22)18-27(23-12-6-19(3)7-13-23)30(28,29)24-16-10-21(25)11-17-24/h6-17H,4-5,18H2,1-3H3
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5.60n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427411
PNG
(CHEMBL2326299)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2cccc(C)c2)cc1
Show InChI InChI=1S/C25H30N2O2S/c1-5-26(6-2)23-16-12-22(13-17-23)19-27(24-14-10-20(3)11-15-24)30(28,29)25-9-7-8-21(4)18-25/h7-18H,5-6,19H2,1-4H3
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5.80n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
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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11n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427422
PNG
(CHEMBL2326288)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O3S/c1-4-26(5-2)21-10-6-19(7-11-21)18-27(22-12-8-20(25)9-13-22)31(28,29)24-16-14-23(30-3)15-17-24/h6-17H,4-5,18H2,1-3H3
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14n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427401
PNG
(CHEMBL2326311)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2cccc(C)c2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C28H38N2O2S/c1-4-29(5-2)26-11-9-22(10-12-26)20-30(33(31,32)27-8-6-7-21(3)13-27)28-17-23-14-24(18-28)16-25(15-23)19-28/h6-13,23-25H,4-5,14-20H2,1-3H3/t23-,24+,25-,28-
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19n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427397
PNG
(CHEMBL2326285)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C23H25ClN2O2S/c1-3-25(4-2)21-14-10-19(11-15-21)18-26(22-16-12-20(24)13-17-22)29(27,28)23-8-6-5-7-9-23/h5-17H,3-4,18H2,1-2H3
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20n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427405
PNG
(CHEMBL2326307)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(F)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H35FN2O2S/c1-3-29(4-2)25-9-5-20(6-10-25)19-30(33(31,32)26-11-7-24(28)8-12-26)27-16-21-13-22(17-27)15-23(14-21)18-27/h5-12,21-23H,3-4,13-19H2,1-2H3/t21-,22+,23-,27-
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25n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427400
PNG
(CHEMBL2321921)
Show SMILES CCN(CC)c1ccc(CN(C(=O)C2CCCCC2)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:26:21:28:24.25.27,26:25:22.21.20:28|
Show InChI InChI=1S/C28H42N2O/c1-3-29(4-2)26-12-10-21(11-13-26)20-30(27(31)25-8-6-5-7-9-25)28-17-22-14-23(18-28)16-24(15-22)19-28/h10-13,22-25H,3-9,14-20H2,1-2H3/t22-,23+,24-,28-
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35n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427423
PNG
(CHEMBL2326287)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H24Cl2N2O2S/c1-3-26(4-2)21-11-5-18(6-12-21)17-27(22-13-7-19(24)8-14-22)30(28,29)23-15-9-20(25)10-16-23/h5-16H,3-4,17H2,1-2H3
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36n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427421
PNG
(CHEMBL2326289)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O2S/c1-4-26(5-2)22-12-8-20(9-13-22)18-27(23-14-10-21(25)11-15-23)30(28,29)24-16-6-19(3)7-17-24/h6-17H,4-5,18H2,1-3H3
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37n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427399
PNG
(CHEMBL2326032)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccc(Cl)cc2)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:28:23:30:26.27.29,28:27:24.23.22:30|
Show InChI InChI=1S/C29H37ClN2O/c1-3-31(4-2)27-11-7-22(8-12-27)20-32(28(33)16-21-5-9-26(30)10-6-21)29-17-23-13-24(18-29)15-25(14-23)19-29/h5-12,23-25H,3-4,13-20H2,1-2H3/t23-,24+,25-,29-
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38n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427402
PNG
(CHEMBL2326310)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(C)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C28H38N2O2S/c1-4-29(5-2)26-10-8-22(9-11-26)20-30(33(31,32)27-12-6-21(3)7-13-27)28-17-23-14-24(18-28)16-25(15-23)19-28/h6-13,23-25H,4-5,14-20H2,1-3H3/t23-,24+,25-,28-
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47n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427398
PNG
(CHEMBL2326033)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccccc2)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:27:22:29:25.26.28,27:26:23.22.21:29|
Show InChI InChI=1S/C29H38N2O/c1-3-30(4-2)27-12-10-23(11-13-27)21-31(28(32)17-22-8-6-5-7-9-22)29-18-24-14-25(19-29)16-26(15-24)20-29/h5-13,24-26H,3-4,14-21H2,1-2H3/t24-,25+,26-,29-
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60n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427409
PNG
(CHEMBL2326301)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccccc2)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C26H30N2O/c1-4-27(5-2)24-17-13-23(14-18-24)20-28(25-15-11-21(3)12-16-25)26(29)19-22-9-7-6-8-10-22/h6-18H,4-5,19-20H2,1-3H3
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72n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427424
PNG
(CHEMBL2326286)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C23H24ClFN2O2S/c1-3-26(4-2)21-11-5-18(6-12-21)17-27(22-13-7-19(24)8-14-22)30(28,29)23-15-9-20(25)10-16-23/h5-16H,3-4,17H2,1-2H3
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73n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427406
PNG
(CHEMBL2326306)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccccc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H36N2O2S/c1-3-28(4-2)25-12-10-21(11-13-25)20-29(32(30,31)26-8-6-5-7-9-26)27-17-22-14-23(18-27)16-24(15-22)19-27/h5-13,22-24H,3-4,14-20H2,1-2H3/t22-,23+,24-,27-
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84n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427408
PNG
(CHEMBL2326302)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccc(Cl)cc2)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C26H29ClN2O/c1-4-28(5-2)24-16-10-22(11-17-24)19-29(25-14-6-20(3)7-15-25)26(30)18-21-8-12-23(27)13-9-21/h6-17H,4-5,18-19H2,1-3H3
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107n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427418
PNG
(CHEMBL2326292)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C25H26Cl2N2O/c1-3-28(4-2)23-13-7-20(8-14-23)18-29(24-15-11-22(27)12-16-24)25(30)17-19-5-9-21(26)10-6-19/h5-16H,3-4,17-18H2,1-2H3
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136n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427403
PNG
(CHEMBL2326309)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(OC)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C28H38N2O3S/c1-4-29(5-2)25-8-6-21(7-9-25)20-30(34(31,32)27-12-10-26(33-3)11-13-27)28-17-22-14-23(18-28)16-24(15-22)19-28/h6-13,22-24H,4-5,14-20H2,1-3H3/t22-,23+,24-,28-
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137n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427421
PNG
(CHEMBL2326289)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O2S/c1-4-26(5-2)22-12-8-20(9-13-22)18-27(23-14-10-21(25)11-15-23)30(28,29)24-16-6-19(3)7-17-24/h6-17H,4-5,18H2,1-3H3
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137n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427417
PNG
(CHEMBL2326293)
Show SMILES CCN(CC)c1ccc(CN(C(=O)C2CCCCC2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C24H31ClN2O/c1-3-26(4-2)22-14-10-19(11-15-22)18-27(23-16-12-21(25)13-17-23)24(28)20-8-6-5-7-9-20/h10-17,20H,3-9,18H2,1-2H3
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164n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427404
PNG
(CHEMBL2326308)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(Cl)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H35ClN2O2S/c1-3-29(4-2)25-9-5-20(6-10-25)19-30(33(31,32)26-11-7-24(28)8-12-26)27-16-21-13-22(17-27)15-23(14-21)18-27/h5-12,21-23H,3-4,13-19H2,1-2H3/t21-,22+,23-,27-
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173n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427442
PNG
(CHEMBL2326304)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N(CCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C22H22ClNO4S2/c1-17-3-11-21(12-4-17)29(25,26)24(16-15-19-7-9-20(23)10-8-19)30(27,28)22-13-5-18(2)6-14-22/h3-14H,15-16H2,1-2H3
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192n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427407
PNG
(CHEMBL2326303)
Show SMILES CCN(CC)c1ccc(CN(C(=O)C2CCCCC2)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C25H34N2O/c1-4-26(5-2)23-17-13-21(14-18-23)19-27(24-15-11-20(3)12-16-24)25(28)22-9-7-6-8-10-22/h11-18,22H,4-10,19H2,1-3H3
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202n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427427
PNG
(CHEMBL2326282)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)C(=O)C1CCCCC1
Show InChI InChI=1S/C25H42N2O/c1-4-7-8-9-13-20-27(25(28)23-14-11-10-12-15-23)21-22-16-18-24(19-17-22)26(5-2)6-3/h16-19,23H,4-15,20-21H2,1-3H3
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212n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427411
PNG
(CHEMBL2326299)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2cccc(C)c2)cc1
Show InChI InChI=1S/C25H30N2O2S/c1-5-26(6-2)23-16-12-22(13-17-23)19-27(24-14-10-20(3)11-15-24)30(28,29)25-9-7-8-21(4)18-25/h7-18H,5-6,19H2,1-4H3
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218n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427407
PNG
(CHEMBL2326303)
Show SMILES CCN(CC)c1ccc(CN(C(=O)C2CCCCC2)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C25H34N2O/c1-4-26(5-2)23-17-13-21(14-18-23)19-27(24-15-11-20(3)12-16-24)25(28)22-9-7-6-8-10-22/h11-18,22H,4-10,19H2,1-3H3
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222n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427419
PNG
(CHEMBL2326291)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(cc2)C(C)C)cc1
Show InChI InChI=1S/C26H31ClN2O2S/c1-5-28(6-2)24-13-7-21(8-14-24)19-29(25-15-11-23(27)12-16-25)32(30,31)26-17-9-22(10-18-26)20(3)4/h7-18,20H,5-6,19H2,1-4H3
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222n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427432
PNG
(CHEMBL2326277)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)Cc1ccccc1
Show InChI InChI=1S/C25H38N2O2S/c1-4-7-8-9-13-20-27(30(28,29)22-24-14-11-10-12-15-24)21-23-16-18-25(19-17-23)26(5-2)6-3/h10-12,14-19H,4-9,13,20-22H2,1-3H3
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273n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427414
PNG
(CHEMBL2326296)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O2S/c1-4-26(5-2)22-14-8-20(9-15-22)18-27(23-12-6-19(3)7-13-23)30(28,29)24-16-10-21(25)11-17-24/h6-17H,4-5,18H2,1-3H3
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412n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427412
PNG
(CHEMBL2326298)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C25H30N2O2S/c1-5-26(6-2)23-15-11-22(12-16-23)19-27(24-13-7-20(3)8-14-24)30(28,29)25-17-9-21(4)10-18-25/h7-18H,5-6,19H2,1-4H3
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437n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427441
PNG
(CHEMBL2326312)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(cc2)C(C)C)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C30H42N2O2S/c1-5-31(6-2)28-11-7-23(8-12-28)21-32(30-18-24-15-25(19-30)17-26(16-24)20-30)35(33,34)29-13-9-27(10-14-29)22(3)4/h7-14,22,24-26H,5-6,15-21H2,1-4H3/t24-,25+,26-,30-
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457n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427416
PNG
(CHEMBL2326294)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C24H28N2O2S/c1-4-25(5-2)22-17-13-21(14-18-22)19-26(23-15-11-20(3)12-16-23)29(27,28)24-9-7-6-8-10-24/h6-18H,4-5,19H2,1-3H3
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514n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427440
PNG
(CHEMBL2326031)
Show SMILES CCCCCCCC(=O)N(Cc1ccc(cc1)N(CC)CC)[C@]12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |r,TLB:29:24:31:27.28.30,29:28:25.24.23:31|
Show InChI InChI=1S/C29H46N2O/c1-4-7-8-9-10-11-28(32)31(22-23-12-14-27(15-13-23)30(5-2)6-3)29-19-24-16-25(20-29)18-26(17-24)21-29/h12-15,24-26H,4-11,16-22H2,1-3H3/t24-,25+,26-,29-
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638n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427431
PNG
(CHEMBL2326278)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)CCCC
Show InChI InChI=1S/C22H40N2O2S/c1-5-9-11-12-13-18-24(27(25,26)19-10-6-2)20-21-14-16-22(17-15-21)23(7-3)8-4/h14-17H,5-13,18-20H2,1-4H3
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680n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427429
PNG
(CHEMBL2326280)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)C(=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C26H37ClN2O/c1-4-7-8-9-10-19-29(26(30)20-22-11-15-24(27)16-12-22)21-23-13-17-25(18-14-23)28(5-2)6-3/h11-18H,4-10,19-21H2,1-3H3
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696n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427415
PNG
(CHEMBL2326295)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C24H27FN2O2S/c1-4-26(5-2)22-14-8-20(9-15-22)18-27(23-12-6-19(3)7-13-23)30(28,29)24-16-10-21(25)11-17-24/h6-17H,4-5,18H2,1-3H3
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858n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427420
PNG
(CHEMBL2326290)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2cccc(C)c2)cc1
Show InChI InChI=1S/C24H27ClN2O2S/c1-4-26(5-2)22-13-9-20(10-14-22)18-27(23-15-11-21(25)12-16-23)30(28,29)24-8-6-7-19(3)17-24/h6-17H,4-5,18H2,1-3H3
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866n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427434
PNG
(CHEMBL2326275)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C24H35FN2O2S/c1-4-7-8-9-10-19-27(30(28,29)24-17-13-22(25)14-18-24)20-21-11-15-23(16-12-21)26(5-2)6-3/h11-18H,4-10,19-20H2,1-3H3
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1.10E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427424
PNG
(CHEMBL2326286)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C23H24ClFN2O2S/c1-3-26(4-2)21-11-5-18(6-12-21)17-27(22-13-7-19(24)8-14-22)30(28,29)23-15-9-20(25)10-16-23/h5-16H,3-4,17H2,1-2H3
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1.13E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427428
PNG
(CHEMBL2326281)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)C(=O)c1ccc(cc1)N(C)C
Show InChI InChI=1S/C27H41N3O/c1-6-9-10-11-12-21-30(27(31)24-15-19-25(20-16-24)28(4)5)22-23-13-17-26(18-14-23)29(7-2)8-3/h13-20H,6-12,21-22H2,1-5H3
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1.28E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427413
PNG
(CHEMBL2326297)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C25H30N2O3S/c1-5-26(6-2)22-13-9-21(10-14-22)19-27(23-11-7-20(3)8-12-23)31(28,29)25-17-15-24(30-4)16-18-25/h7-18H,5-6,19H2,1-4H3
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1.30E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427430
PNG
(CHEMBL2326279)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)C(=O)Cc1ccccc1
Show InChI InChI=1S/C26H38N2O/c1-4-7-8-9-13-20-28(26(29)21-23-14-11-10-12-15-23)22-24-16-18-25(19-17-24)27(5-2)6-3/h10-12,14-19H,4-9,13,20-22H2,1-3H3
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1.31E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427397
PNG
(CHEMBL2326285)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C23H25ClN2O2S/c1-3-25(4-2)21-14-10-19(11-15-21)18-26(22-16-12-20(24)13-17-22)29(27,28)23-8-6-5-7-9-23/h5-17H,3-4,18H2,1-2H3
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1.77E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427418
PNG
(CHEMBL2326292)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C25H26Cl2N2O/c1-3-28(4-2)23-13-7-20(8-14-23)18-29(24-15-11-22(27)12-16-24)25(30)17-19-5-9-21(26)10-6-19/h5-16H,3-4,17-18H2,1-2H3
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>2.00E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427404
PNG
(CHEMBL2326308)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(Cl)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H35ClN2O2S/c1-3-29(4-2)25-9-5-20(6-10-25)19-30(33(31,32)26-11-7-24(28)8-12-26)27-16-21-13-22(17-27)15-23(14-21)18-27/h5-12,21-23H,3-4,13-19H2,1-2H3/t21-,22+,23-,27-
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2.03E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427438
PNG
(CHEMBL2326035)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1cccc(C)c1
Show InChI InChI=1S/C25H38N2O2S/c1-5-8-9-10-11-19-27(30(28,29)25-14-12-13-22(4)20-25)21-23-15-17-24(18-16-23)26(6-2)7-3/h12-18,20H,5-11,19,21H2,1-4H3
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2.30E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427439
PNG
(CHEMBL2326034)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C25H38N2O2S/c1-5-8-9-10-11-20-27(30(28,29)25-18-12-22(4)13-19-25)21-23-14-16-24(17-15-23)26(6-2)7-3/h12-19H,5-11,20-21H2,1-4H3
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2.75E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427408
PNG
(CHEMBL2326302)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccc(Cl)cc2)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C26H29ClN2O/c1-4-28(5-2)24-16-10-22(11-17-24)19-29(25-14-6-20(3)7-15-25)26(30)18-21-8-12-23(27)13-9-21/h6-17H,4-5,18-19H2,1-3H3
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3.20E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427410
PNG
(CHEMBL2326300)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(cc2)C(C)C)cc1
Show InChI InChI=1S/C27H34N2O2S/c1-6-28(7-2)25-16-10-23(11-17-25)20-29(26-14-8-22(5)9-15-26)32(30,31)27-18-12-24(13-19-27)21(3)4/h8-19,21H,6-7,20H2,1-5H3
PDB

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3.37E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427405
PNG
(CHEMBL2326307)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(F)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H35FN2O2S/c1-3-29(4-2)25-9-5-20(6-10-25)19-30(33(31,32)26-11-7-24(28)8-12-26)27-16-21-13-22(17-27)15-23(14-21)18-27/h5-12,21-23H,3-4,13-19H2,1-2H3/t21-,22+,23-,27-
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4.27E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427436
PNG
(CHEMBL2326273)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C25H38N2O3S/c1-5-8-9-10-11-20-27(31(28,29)25-18-16-24(30-4)17-19-25)21-22-12-14-23(15-13-22)26(6-2)7-3/h12-19H,5-11,20-21H2,1-4H3
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5.19E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427423
PNG
(CHEMBL2326287)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H24Cl2N2O2S/c1-3-26(4-2)21-11-5-18(6-12-21)17-27(22-13-7-19(24)8-14-22)30(28,29)23-15-9-20(25)10-16-23/h5-16H,3-4,17H2,1-2H3
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6.62E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427433
PNG
(CHEMBL2326276)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H35ClN2O2S/c1-4-7-8-9-10-19-27(30(28,29)24-17-13-22(25)14-18-24)20-21-11-15-23(16-12-21)26(5-2)6-3/h11-18H,4-10,19-20H2,1-3H3
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6.74E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427425
PNG
(CHEMBL2326284)
Show SMILES CCN(CC)c1ccc(CNc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C17H21ClN2/c1-3-20(4-2)17-11-5-14(6-12-17)13-19-16-9-7-15(18)8-10-16/h5-12,19H,3-4,13H2,1-2H3
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6.74E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427403
PNG
(CHEMBL2326309)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(OC)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C28H38N2O3S/c1-4-29(5-2)25-8-6-21(7-9-25)20-30(34(31,32)27-12-10-26(33-3)11-13-27)28-17-22-14-23(18-28)16-24(15-22)19-28/h6-13,22-24H,4-5,14-20H2,1-3H3/t22-,23+,24-,28-
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7.30E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427401
PNG
(CHEMBL2326311)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2cccc(C)c2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C28H38N2O2S/c1-4-29(5-2)26-11-9-22(10-12-26)20-30(33(31,32)27-8-6-7-21(3)13-27)28-17-23-14-24(18-28)16-25(15-23)19-28/h6-13,23-25H,4-5,14-20H2,1-3H3/t23-,24+,25-,28-
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8.22E+3n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427406
PNG
(CHEMBL2326306)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccccc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H36N2O2S/c1-3-28(4-2)25-12-10-21(11-13-25)20-29(32(30,31)26-8-6-5-7-9-26)27-17-22-14-23(18-27)16-24(15-22)19-27/h5-13,22-24H,3-4,14-20H2,1-2H3/t22-,23+,24-,27-
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1.10E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427437
PNG
(CHEMBL2326036)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1ccc(cc1)C(C)C
Show InChI InChI=1S/C27H42N2O2S/c1-6-9-10-11-12-21-29(22-24-13-17-26(18-14-24)28(7-2)8-3)32(30,31)27-19-15-25(16-20-27)23(4)5/h13-20,23H,6-12,21-22H2,1-5H3
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1.30E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427443
PNG
(CHEMBL2326305)
Show SMILES CCN(CC)c1ccc(CN[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C21H32N2/c1-3-23(4-2)20-7-5-16(6-8-20)15-22-21-12-17-9-18(13-21)11-19(10-17)14-21/h5-8,17-19,22H,3-4,9-15H2,1-2H3/t17-,18+,19-,21-
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2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427402
PNG
(CHEMBL2326310)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(C)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C28H38N2O2S/c1-4-29(5-2)26-10-8-22(9-11-26)20-30(33(31,32)27-12-6-21(3)7-13-27)28-17-23-14-24(18-28)16-25(15-23)19-28/h6-13,23-25H,4-5,14-20H2,1-3H3/t23-,24+,25-,28-
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427435
PNG
(CHEMBL2326274)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)S(=O)(=O)c1ccc(OC(C)C)cc1
Show InChI InChI=1S/C27H42N2O3S/c1-6-9-10-11-12-21-29(22-24-13-15-25(16-14-24)28(7-2)8-3)33(30,31)27-19-17-26(18-20-27)32-23(4)5/h13-20,23H,6-12,21-22H2,1-5H3
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427409
PNG
(CHEMBL2326301)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccccc2)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C26H30N2O/c1-4-27(5-2)24-17-13-23(14-18-24)20-28(25-15-11-21(3)12-16-25)26(29)19-22-9-7-6-8-10-22/h6-18H,4-5,19-20H2,1-3H3
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427426
PNG
(CHEMBL2326283)
Show SMILES CCCCCCCN(Cc1ccc(cc1)N(CC)CC)C(=O)CCCCCCC
Show InChI InChI=1S/C26H46N2O/c1-5-9-11-13-15-17-26(29)28(22-16-14-12-10-6-2)23-24-18-20-25(21-19-24)27(7-3)8-4/h18-21H,5-17,22-23H2,1-4H3
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB2 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427400
PNG
(CHEMBL2321921)
Show SMILES CCN(CC)c1ccc(CN(C(=O)C2CCCCC2)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:26:21:28:24.25.27,26:25:22.21.20:28|
Show InChI InChI=1S/C28H42N2O/c1-3-29(4-2)26-12-10-21(11-13-26)20-30(27(31)25-8-6-5-7-9-25)28-17-22-14-23(18-28)16-24(15-22)19-28/h10-13,22-25H,3-9,14-20H2,1-2H3/t22-,23+,24-,28-
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427422
PNG
(CHEMBL2326288)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O3S/c1-4-26(5-2)21-10-6-19(7-11-21)18-27(22-12-8-20(25)9-13-22)31(28,29)24-16-14-23(30-3)15-17-24/h6-17H,4-5,18H2,1-3H3
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427398
PNG
(CHEMBL2326033)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccccc2)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:27:22:29:25.26.28,27:26:23.22.21:29|
Show InChI InChI=1S/C29H38N2O/c1-3-30(4-2)27-12-10-23(11-13-27)21-31(28(32)17-22-8-6-5-7-9-22)29-18-24-14-25(19-29)16-26(15-24)20-29/h5-13,24-26H,3-4,14-21H2,1-2H3/t24-,25+,26-,29-
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427399
PNG
(CHEMBL2326032)
Show SMILES CCN(CC)c1ccc(CN(C(=O)Cc2ccc(Cl)cc2)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)cc1 |r,TLB:28:23:30:26.27.29,28:27:24.23.22:30|
Show InChI InChI=1S/C29H37ClN2O/c1-3-31(4-2)27-11-7-22(8-12-27)20-32(28(33)16-21-5-9-26(30)10-6-21)29-17-23-13-24(18-29)15-25(14-23)19-29/h5-12,23-25H,3-4,13-20H2,1-2H3/t23-,24+,25-,29-
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50427417
PNG
(CHEMBL2326293)
Show SMILES CCN(CC)c1ccc(CN(C(=O)C2CCCCC2)c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C24H31ClN2O/c1-3-26(4-2)22-14-10-19(11-15-22)18-27(23-16-12-21(25)13-17-23)24(28)20-8-6-5-7-9-20/h10-17,20H,3-9,18H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor (unknown origin) after 1 hr by scintillation counting analysis


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427422
PNG
(CHEMBL2326288)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C24H27ClN2O3S/c1-4-26(5-2)21-10-6-19(7-11-21)18-27(22-12-8-20(25)9-13-22)31(28,29)24-16-14-23(30-3)15-17-24/h6-17H,4-5,18H2,1-3H3
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n/an/an/an/a 16n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427405
PNG
(CHEMBL2326307)
Show SMILES CCN(CC)c1ccc(CN([C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)S(=O)(=O)c2ccc(F)cc2)cc1 |r,TLB:18:13:20:16.17.19,18:17:14.13.12:20|
Show InChI InChI=1S/C27H35FN2O2S/c1-3-29(4-2)25-9-5-20(6-10-25)19-30(33(31,32)26-11-7-24(28)8-12-26)27-16-21-13-22(17-27)15-23(14-21)18-27/h5-12,21-23H,3-4,13-19H2,1-2H3/t21-,22+,23-,27-
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n/an/an/an/a 268n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50399157
PNG
(CHEMBL2179724)
Show SMILES CCCCCCC(C)(C)c1cc(OC)c([C@H]2C=C(CO)[C@H]3C[C@@H]2C3(C)C)c(OC)c1 |r,t:16|
Show InChI InChI=1S/C27H42O3/c1-8-9-10-11-12-26(2,3)19-14-23(29-6)25(24(15-19)30-7)20-13-18(17-28)21-16-22(20)27(21,4)5/h13-15,20-22,28H,8-12,16-17H2,1-7H3/t20-,21+,22-/m0/s1
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n/an/an/an/a 84n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427413
PNG
(CHEMBL2326297)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C25H30N2O3S/c1-5-26(6-2)22-13-9-21(10-14-22)19-27(23-11-7-20(3)8-12-23)31(28,29)25-17-15-24(30-4)16-18-25/h7-18H,5-6,19H2,1-4H3
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n/an/an/an/a 43n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50427416
PNG
(CHEMBL2326294)
Show SMILES CCN(CC)c1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C24H28N2O2S/c1-4-25(5-2)22-17-13-21(14-18-22)19-26(23-15-11-20(3)12-16-23)29(27,28)24-9-7-6-8-10-24/h6-18H,4-5,19H2,1-3H3
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n/an/an/an/a 609n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50072775
PNG
(2-((1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohe...)
Show SMILES CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)c(O)c1 |r|
Show InChI InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3/t18-,20-,22-/m1/s1
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n/an/an/an/a 47n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50180022
PNG
(5-(4-chloro-3-methyl-phenyl)-1-(4-methyl-benzyl)-1...)
Show SMILES Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2C3(C)CCC(C3)C2(C)C)cc1 |THB:21:22:26.25:28|
Show InChI InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)
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n/an/an/an/a 154n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor expressed in CHO cells assessed as increase in forskolin-induced cAMP production after 45 mins in pres...


J Med Chem 56: 2045-58 (2013)


Article DOI: 10.1021/jm3017464
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%