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PubMed code 30077609

Compile data set for download or QSAR
Found 74 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 1


(Homo sapiens (Human))		BDBM50463404
PNG
(CHEMBL4244751)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)CC1CCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H28Cl2N6O/c29-20-9-11-21(12-10-20)36-26(22-7-3-4-8-23(22)30)33-25-27(31-18-32-28(25)36)35-15-13-34(14-16-35)24(37)17-19-5-1-2-6-19/h3-4,7-12,18-19H,1-2,5-6,13-17H2
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 0.400n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463413
PNG
(CHEMBL4242477)
Show SMILES CCCCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H26Cl2N6O2S/c1-2-3-16-36(34,35)32-14-12-31(13-15-32)24-22-25(29-17-28-24)33(19-10-8-18(26)9-11-19)23(30-22)20-6-4-5-7-21(20)27/h4-11,17H,2-3,12-16H2,1H3
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 0.600n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
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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 0.700n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463410
PNG
(CHEMBL4250064)
Show SMILES FC(F)(F)C(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H17Cl2F3N6O/c24-14-5-7-15(8-6-14)34-19(16-3-1-2-4-17(16)25)31-18-20(29-13-30-21(18)34)32-9-11-33(12-10-32)22(35)23(26,27)28/h1-8,13H,9-12H2
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 1n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463398
PNG
(CHEMBL4238756)
Show SMILES FC(F)(F)CCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H21Cl2F3N6O2S/c25-16-5-7-17(8-6-16)35-21(18-3-1-2-4-19(18)26)32-20-22(30-15-31-23(20)35)33-10-12-34(13-11-33)38(36,37)14-9-24(27,28)29/h1-8,15H,9-14H2
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 1.20n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463403
PNG
(CHEMBL4248795)
Show SMILES CCCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24Cl2N6O2S/c1-2-15-35(33,34)31-13-11-30(12-14-31)23-21-24(28-16-27-23)32(18-9-7-17(25)8-10-18)22(29-21)19-5-3-4-6-20(19)26/h3-10,16H,2,11-15H2,1H3
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 1.20n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463414
PNG
(CHEMBL4246283)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)NC1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H29Cl2N7O/c29-19-10-12-21(13-11-19)37-25(22-8-4-5-9-23(22)30)34-24-26(31-18-32-27(24)37)35-14-16-36(17-15-35)28(38)33-20-6-2-1-3-7-20/h4-5,8-13,18,20H,1-3,6-7,14-17H2,(H,33,38)
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 1.40n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463417
PNG
(CHEMBL4244992)
Show SMILES CC(C)S(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24Cl2N6O2S/c1-16(2)35(33,34)31-13-11-30(12-14-31)23-21-24(28-15-27-23)32(18-9-7-17(25)8-10-18)22(29-21)19-5-3-4-6-20(19)26/h3-10,15-16H,11-14H2,1-2H3
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 1.40n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463419
PNG
(CHEMBL4244624)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)S(=O)(=O)CC1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H30Cl2N6O2S/c29-21-10-12-22(13-11-21)36-26(23-8-4-5-9-24(23)30)33-25-27(31-19-32-28(25)36)34-14-16-35(17-15-34)39(37,38)18-20-6-2-1-3-7-20/h4-5,8-13,19-20H,1-3,6-7,14-18H2
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 1.70n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463418
PNG
(CHEMBL4238314)
Show SMILES CC(C)CS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H26Cl2N6O2S/c1-17(2)15-36(34,35)32-13-11-31(12-14-32)24-22-25(29-16-28-24)33(19-9-7-18(26)8-10-19)23(30-22)20-5-3-4-6-21(20)27/h3-10,16-17H,11-15H2,1-2H3
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 2n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463422
PNG
(CHEMBL4248778)
Show SMILES CC(C)(C)CC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C27H28Cl2N6O/c1-27(2,3)16-22(36)33-12-14-34(15-13-33)25-23-26(31-17-30-25)35(19-10-8-18(28)9-11-19)24(32-23)20-6-4-5-7-21(20)29/h4-11,17H,12-16H2,1-3H3
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 2n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463423
PNG
(CHEMBL4249233)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)C1CCSCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H26Cl2N6OS/c28-19-5-7-20(8-6-19)35-24(21-3-1-2-4-22(21)29)32-23-25(30-17-31-26(23)35)33-11-13-34(14-12-33)27(36)18-9-15-37-16-10-18/h1-8,17-18H,9-16H2
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 2n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463420
PNG
(CHEMBL4237503)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)OCC1CCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H26Cl2N6O2/c28-19-8-10-20(11-9-19)35-24(21-6-1-2-7-22(21)29)32-23-25(30-17-31-26(23)35)33-12-14-34(15-13-33)27(36)37-16-18-4-3-5-18/h1-2,6-11,17-18H,3-5,12-16H2
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 3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463425
PNG
(CHEMBL4249388)
Show SMILES CC(C(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)c1ccccc1
Show InChI InChI=1S/C30H26Cl2N6O/c1-20(21-7-3-2-4-8-21)30(39)37-17-15-36(16-18-37)28-26-29(34-19-33-28)38(23-13-11-22(31)12-14-23)27(35-26)24-9-5-6-10-25(24)32/h2-14,19-20H,15-18H2,1H3
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 3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463405
PNG
(CHEMBL4237943)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)OC1CCC1)-c1ccccc1Cl
Show InChI InChI=1S/C26H24Cl2N6O2/c27-17-8-10-18(11-9-17)34-23(20-6-1-2-7-21(20)28)31-22-24(29-16-30-25(22)34)32-12-14-33(15-13-32)26(35)36-19-4-3-5-19/h1-2,6-11,16,19H,3-5,12-15H2
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 3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463416
PNG
(CHEMBL4245455)
Show SMILES CCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H22Cl2N6O2S/c1-2-34(32,33)30-13-11-29(12-14-30)22-20-23(27-15-26-22)31(17-9-7-16(24)8-10-17)21(28-20)18-5-3-4-6-19(18)25/h3-10,15H,2,11-14H2,1H3
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 3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463402
PNG
(CHEMBL4245443)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)S(=O)(=O)CC1CCOCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H28Cl2N6O3S/c28-20-5-7-21(8-6-20)35-25(22-3-1-2-4-23(22)29)32-24-26(30-18-31-27(24)35)33-11-13-34(14-12-33)39(36,37)17-19-9-15-38-16-10-19/h1-8,18-19H,9-17H2
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 3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463401
PNG
(CHEMBL4242565)
Show SMILES FC(F)Oc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cn1
Show InChI InChI=1S/C28H22Cl2F2N8O2/c29-17-5-8-19(9-6-17)40-24(20-3-1-2-4-21(20)30)37-23-25(34-16-35-26(23)40)38-11-13-39(14-12-38)28(41)36-18-7-10-22(33-15-18)42-27(31)32/h1-10,15-16,27H,11-14H2,(H,36,41)
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 4n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463409
PNG
(CHEMBL4249237)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C26H26Cl2N6O2/c1-26(2,3)36-25(35)33-14-12-32(13-15-33)23-21-24(30-16-29-23)34(18-10-8-17(27)9-11-18)22(31-21)19-6-4-5-7-20(19)28/h4-11,16H,12-15H2,1-3H3
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 5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463400
PNG
(CHEMBL4245429)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)NC1CCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H27Cl2N7O/c28-18-9-11-20(12-10-18)36-24(21-7-3-4-8-22(21)29)33-23-25(30-17-31-26(23)36)34-13-15-35(16-14-34)27(37)32-19-5-1-2-6-19/h3-4,7-12,17,19H,1-2,5-6,13-16H2,(H,32,37)
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 5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463408
PNG
(CHEMBL4249248)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)S(=O)(=O)C1CC1)-c1ccccc1Cl
Show InChI InChI=1S/C24H22Cl2N6O2S/c25-16-5-7-17(8-6-16)32-22(19-3-1-2-4-20(19)26)29-21-23(27-15-28-24(21)32)30-11-13-31(14-12-30)35(33,34)18-9-10-18/h1-8,15,18H,9-14H2
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 5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463415
PNG
(CHEMBL4238830)
Show SMILES Fc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1F
Show InChI InChI=1S/C28H21Cl2F2N7O/c29-17-5-8-19(9-6-17)39-25(20-3-1-2-4-21(20)30)36-24-26(33-16-34-27(24)39)37-11-13-38(14-12-37)28(40)35-18-7-10-22(31)23(32)15-18/h1-10,15-16H,11-14H2,(H,35,40)
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 5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463428
PNG
(CHEMBL4245076)
Show SMILES Fc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)c(F)c1
Show InChI InChI=1S/C28H21Cl2F2N7O/c29-17-5-8-19(9-6-17)39-25(20-3-1-2-4-21(20)30)36-24-26(33-16-34-27(24)39)37-11-13-38(14-12-37)28(40)35-23-10-7-18(31)15-22(23)32/h1-10,15-16H,11-14H2,(H,35,40)
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 5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463396
PNG
(CHEMBL4237291)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)C1COc2ccccc2O1)-c1ccccc1Cl
Show InChI InChI=1S/C30H24Cl2N6O3/c31-19-9-11-20(12-10-19)38-27(21-5-1-2-6-22(21)32)35-26-28(33-18-34-29(26)38)36-13-15-37(16-14-36)30(39)25-17-40-23-7-3-4-8-24(23)41-25/h1-12,18,25H,13-17H2
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 5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463426
PNG
(CHEMBL4245522)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccccc1)-c1ccccc1Cl
Show InChI InChI=1S/C28H23Cl2N7O/c29-19-10-12-21(13-11-19)37-25(22-8-4-5-9-23(22)30)34-24-26(31-18-32-27(24)37)35-14-16-36(17-15-35)28(38)33-20-6-2-1-3-7-20/h1-13,18H,14-17H2,(H,33,38)
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 6n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463397
PNG
(CHEMBL4249329)
Show SMILES Fc1ccccc1NC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H22Cl2FN7O/c29-18-9-11-19(12-10-18)38-25(20-5-1-2-6-21(20)30)35-24-26(32-17-33-27(24)38)36-13-15-37(16-14-36)28(39)34-23-8-4-3-7-22(23)31/h1-12,17H,13-16H2,(H,34,39)
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 6n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463399
PNG
(CHEMBL4242001)
Show SMILES CCCCC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C26H26Cl2N6O/c1-2-3-8-22(35)32-13-15-33(16-14-32)25-23-26(30-17-29-25)34(19-11-9-18(27)10-12-19)24(31-23)20-6-4-5-7-21(20)28/h4-7,9-12,17H,2-3,8,13-16H2,1H3
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 6n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463427
PNG
(CHEMBL4241316)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccccn1)-c1ccccc1Cl
Show InChI InChI=1S/C27H22Cl2N8O/c28-18-8-10-19(11-9-18)37-24(20-5-1-2-6-21(20)29)34-23-25(31-17-32-26(23)37)35-13-15-36(16-14-35)27(38)33-22-7-3-4-12-30-22/h1-12,17H,13-16H2,(H,30,33,38)
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 6n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463411
PNG
(CHEMBL4240555)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)CC1CCOC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H26Cl2N6O2/c28-19-5-7-20(8-6-19)35-25(21-3-1-2-4-22(21)29)32-24-26(30-17-31-27(24)35)34-12-10-33(11-13-34)23(36)15-18-9-14-37-16-18/h1-8,17-18H,9-16H2
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 8n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463421
PNG
(CHEMBL4238299)
Show SMILES CCOCC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H24Cl2N6O2/c1-2-35-15-21(34)31-11-13-32(14-12-31)24-22-25(29-16-28-24)33(18-9-7-17(26)8-10-18)23(30-22)19-5-3-4-6-20(19)27/h3-10,16H,2,11-15H2,1H3
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 11n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463412
PNG
(CHEMBL4245144)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)N1CCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C26H25Cl2N7O/c27-18-7-9-19(10-8-18)35-23(20-5-1-2-6-21(20)28)31-22-24(29-17-30-25(22)35)32-13-15-34(16-14-32)26(36)33-11-3-4-12-33/h1-2,5-10,17H,3-4,11-16H2
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 13n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463429
PNG
(CHEMBL4248870)
Show SMILES Fc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C28H22Cl2FN7O/c29-18-5-11-21(12-6-18)38-25(22-3-1-2-4-23(22)30)35-24-26(32-17-33-27(24)38)36-13-15-37(16-14-36)28(39)34-20-9-7-19(31)8-10-20/h1-12,17H,13-16H2,(H,34,39)
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 19n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463424
PNG
(CHEMBL4239666)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)CN1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H29Cl2N7O/c29-20-8-10-21(11-9-20)37-26(22-6-2-3-7-23(22)30)33-25-27(31-19-32-28(25)37)36-16-14-35(15-17-36)24(38)18-34-12-4-1-5-13-34/h2-3,6-11,19H,1,4-5,12-18H2
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 21n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463407
PNG
(CHEMBL4241237)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20Cl2N6O2S/c1-33(31,32)29-12-10-28(11-13-29)21-19-22(26-14-25-21)30(16-8-6-15(23)7-9-16)20(27-19)17-4-2-3-5-18(17)24/h2-9,14H,10-13H2,1H3
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 24n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463406
PNG
(CHEMBL4242177)
Show SMILES FC(F)(F)C1(CCCC1)NC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H26Cl2F3N7O/c29-18-7-9-19(10-8-18)40-23(20-5-1-2-6-21(20)30)36-22-24(34-17-35-25(22)40)38-13-15-39(16-14-38)26(41)37-27(28(31,32)33)11-3-4-12-27/h1-2,5-10,17H,3-4,11-16H2,(H,37,41)
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 24n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463430
PNG
(CHEMBL4239762)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)NCC1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C29H31Cl2N7O/c30-21-10-12-22(13-11-21)38-26(23-8-4-5-9-24(23)31)35-25-27(33-19-34-28(25)38)36-14-16-37(17-15-36)29(39)32-18-20-6-2-1-3-7-20/h4-5,8-13,19-20H,1-3,6-7,14-18H2,(H,32,39)
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 43n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463419
PNG
(CHEMBL4244624)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)S(=O)(=O)CC1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H30Cl2N6O2S/c29-21-10-12-22(13-11-21)36-26(23-8-4-5-9-24(23)30)33-25-27(31-19-32-28(25)36)34-14-16-35(17-15-34)39(37,38)18-20-6-2-1-3-7-20/h4-5,8-13,19-20H,1-3,6-7,14-18H2
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 91n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463410
PNG
(CHEMBL4250064)
Show SMILES FC(F)(F)C(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H17Cl2F3N6O/c24-14-5-7-15(8-6-14)34-19(16-3-1-2-4-17(16)25)31-18-20(29-13-30-21(18)34)32-9-11-33(12-10-32)22(35)23(26,27)28/h1-8,13H,9-12H2
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 130n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463431
PNG
(CHEMBL4241849)
Show SMILES Fc1ccccc1S(=O)(=O)NC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H22Cl2FN7O3S/c29-18-9-11-19(12-10-18)38-25(20-5-1-2-6-21(20)30)34-24-26(32-17-33-27(24)38)36-13-15-37(16-14-36)28(39)35-42(40,41)23-8-4-3-7-22(23)31/h1-12,17H,13-16H2,(H,35,39)
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 250n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463399
PNG
(CHEMBL4242001)
Show SMILES CCCCC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C26H26Cl2N6O/c1-2-3-8-22(35)32-13-15-33(16-14-32)25-23-26(30-17-29-25)34(19-11-9-18(27)10-12-19)24(31-23)20-6-4-5-7-21(20)28/h4-7,9-12,17H,2-3,8,13-16H2,1H3
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 400n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463398
PNG
(CHEMBL4238756)
Show SMILES FC(F)(F)CCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H21Cl2F3N6O2S/c25-16-5-7-17(8-6-16)35-21(18-3-1-2-4-19(18)26)32-20-22(30-15-31-23(20)35)33-10-12-34(13-11-33)38(36,37)14-9-24(27,28)29/h1-8,15H,9-14H2
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 500n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463413
PNG
(CHEMBL4242477)
Show SMILES CCCCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H26Cl2N6O2S/c1-2-3-16-36(34,35)32-14-12-31(13-15-32)24-22-25(29-17-28-24)33(19-10-8-18(26)9-11-19)23(30-22)20-6-4-5-7-21(20)27/h4-11,17H,2-3,12-16H2,1H3
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 500n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463423
PNG
(CHEMBL4249233)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)C1CCSCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H26Cl2N6OS/c28-19-5-7-20(8-6-19)35-24(21-3-1-2-4-22(21)29)32-23-25(30-17-31-26(23)35)33-11-13-34(14-12-33)27(36)18-9-15-37-16-10-18/h1-8,17-18H,9-16H2
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 530n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463425
PNG
(CHEMBL4249388)
Show SMILES CC(C(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)c1ccccc1
Show InChI InChI=1S/C30H26Cl2N6O/c1-20(21-7-3-2-4-8-21)30(39)37-17-15-36(16-18-37)28-26-29(34-19-33-28)38(23-13-11-22(31)12-14-23)27(35-26)24-9-5-6-10-25(24)32/h2-14,19-20H,15-18H2,1H3
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 560n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463396
PNG
(CHEMBL4237291)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)C1COc2ccccc2O1)-c1ccccc1Cl
Show InChI InChI=1S/C30H24Cl2N6O3/c31-19-9-11-20(12-10-19)38-27(21-5-1-2-6-22(21)32)35-26-28(33-18-34-29(26)38)36-13-15-37(16-14-36)30(39)25-17-40-23-7-3-4-8-24(23)41-25/h1-12,18,25H,13-17H2
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 610n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463414
PNG
(CHEMBL4246283)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)NC1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H29Cl2N7O/c29-19-10-12-21(13-11-19)37-25(22-8-4-5-9-23(22)30)34-24-26(31-18-32-27(24)37)35-14-16-36(17-15-35)28(38)33-20-6-2-1-3-7-20/h4-5,8-13,18,20H,1-3,6-7,14-17H2,(H,33,38)
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 620n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463400
PNG
(CHEMBL4245429)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)NC1CCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H27Cl2N7O/c28-18-9-11-20(12-10-18)36-24(21-7-3-4-8-22(21)29)33-23-25(30-17-31-26(23)36)34-13-15-35(16-14-34)27(37)32-19-5-1-2-6-19/h3-4,7-12,17,19H,1-2,5-6,13-16H2,(H,32,37)
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 740n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463430
PNG
(CHEMBL4239762)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)NCC1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C29H31Cl2N7O/c30-21-10-12-22(13-11-21)38-26(23-8-4-5-9-24(23)31)35-25-27(33-19-34-28(25)38)36-14-16-37(17-15-36)29(39)32-18-20-6-2-1-3-7-20/h4-5,8-13,19-20H,1-3,6-7,14-18H2,(H,32,39)
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 740n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463403
PNG
(CHEMBL4248795)
Show SMILES CCCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24Cl2N6O2S/c1-2-15-35(33,34)31-13-11-30(12-14-31)23-21-24(28-16-27-23)32(18-9-7-17(25)8-10-18)22(29-21)19-5-3-4-6-20(19)26/h3-10,16H,2,11-15H2,1H3
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 850n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463416
PNG
(CHEMBL4245455)
Show SMILES CCS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H22Cl2N6O2S/c1-2-34(32,33)30-13-11-29(12-14-30)22-20-23(27-15-26-22)31(17-9-7-16(24)8-10-17)21(28-20)18-5-3-4-6-19(18)25/h3-10,15H,2,11-14H2,1H3
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 980n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463417
PNG
(CHEMBL4244992)
Show SMILES CC(C)S(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24Cl2N6O2S/c1-16(2)35(33,34)31-13-11-30(12-14-31)23-21-24(28-15-27-23)32(18-9-7-17(25)8-10-18)22(29-21)19-5-3-4-6-20(19)26/h3-10,15-16H,11-14H2,1-2H3
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 980n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463397
PNG
(CHEMBL4249329)
Show SMILES Fc1ccccc1NC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H22Cl2FN7O/c29-18-9-11-19(12-10-18)38-25(20-5-1-2-6-21(20)30)35-24-26(32-17-33-27(24)38)36-13-15-37(16-14-36)28(39)34-23-8-4-3-7-22(23)31/h1-12,17H,13-16H2,(H,34,39)
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 1.30E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463406
PNG
(CHEMBL4242177)
Show SMILES FC(F)(F)C1(CCCC1)NC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H26Cl2F3N7O/c29-18-7-9-19(10-8-18)40-23(20-5-1-2-6-21(20)30)36-22-24(34-17-35-25(22)40)38-13-15-39(16-14-38)26(41)37-27(28(31,32)33)11-3-4-12-27/h1-2,5-10,17H,3-4,11-16H2,(H,37,41)
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 1.30E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463407
PNG
(CHEMBL4241237)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20Cl2N6O2S/c1-33(31,32)29-12-10-28(11-13-29)21-19-22(26-14-25-21)30(16-8-6-15(23)7-9-16)20(27-19)17-4-2-3-5-18(17)24/h2-9,14H,10-13H2,1H3
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 1.70E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463429
PNG
(CHEMBL4248870)
Show SMILES Fc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C28H22Cl2FN7O/c29-18-5-11-21(12-6-18)38-25(22-3-1-2-4-23(22)30)35-24-26(32-17-33-27(24)38)36-13-15-37(16-14-36)28(39)34-20-9-7-19(31)8-10-20/h1-12,17H,13-16H2,(H,34,39)
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 2.00E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463408
PNG
(CHEMBL4249248)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)S(=O)(=O)C1CC1)-c1ccccc1Cl
Show InChI InChI=1S/C24H22Cl2N6O2S/c25-16-5-7-17(8-6-16)32-22(19-3-1-2-4-20(19)26)29-21-23(27-15-28-24(21)32)30-11-13-31(14-12-30)35(33,34)18-9-10-18/h1-8,15,18H,9-14H2
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 2.30E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463426
PNG
(CHEMBL4245522)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccccc1)-c1ccccc1Cl
Show InChI InChI=1S/C28H23Cl2N7O/c29-19-10-12-21(13-11-19)37-25(22-8-4-5-9-23(22)30)34-24-26(31-18-32-27(24)37)35-14-16-36(17-15-35)28(38)33-20-6-2-1-3-7-20/h1-13,18H,14-17H2,(H,33,38)
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 2.40E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463418
PNG
(CHEMBL4238314)
Show SMILES CC(C)CS(=O)(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H26Cl2N6O2S/c1-17(2)15-36(34,35)32-13-11-31(12-14-32)24-22-25(29-16-28-24)33(19-9-7-18(26)8-10-19)23(30-22)20-5-3-4-6-21(20)27/h3-10,16-17H,11-15H2,1-2H3
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 2.80E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463402
PNG
(CHEMBL4245443)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)S(=O)(=O)CC1CCOCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H28Cl2N6O3S/c28-20-5-7-21(8-6-20)35-25(22-3-1-2-4-23(22)29)32-24-26(30-18-31-27(24)35)33-11-13-34(14-12-33)39(36,37)17-19-9-15-38-16-10-19/h1-8,18-19H,9-17H2
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 3.00E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463411
PNG
(CHEMBL4240555)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)CC1CCOC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H26Cl2N6O2/c28-19-5-7-20(8-6-19)35-25(21-3-1-2-4-22(21)29)32-24-26(30-17-31-27(24)35)34-12-10-33(11-13-34)23(36)15-18-9-14-37-16-18/h1-8,17-18H,9-16H2
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 3.00E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463428
PNG
(CHEMBL4245076)
Show SMILES Fc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)c(F)c1
Show InChI InChI=1S/C28H21Cl2F2N7O/c29-17-5-8-19(9-6-17)39-25(20-3-1-2-4-21(20)30)36-24-26(33-16-34-27(24)39)37-11-13-38(14-12-37)28(40)35-23-10-7-18(31)15-22(23)32/h1-10,15-16H,11-14H2,(H,35,40)
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 3.20E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463405
PNG
(CHEMBL4237943)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)OC1CCC1)-c1ccccc1Cl
Show InChI InChI=1S/C26H24Cl2N6O2/c27-17-8-10-18(11-9-17)34-23(20-6-1-2-7-21(20)28)31-22-24(29-16-30-25(22)34)32-12-14-33(15-13-32)26(35)36-19-4-3-5-19/h1-2,6-11,16,19H,3-5,12-15H2
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 3.40E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463409
PNG
(CHEMBL4249237)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C26H26Cl2N6O2/c1-26(2,3)36-25(35)33-14-12-32(13-15-33)23-21-24(30-16-29-23)34(18-10-8-17(27)9-11-18)22(31-21)19-6-4-5-7-20(19)28/h4-11,16H,12-15H2,1-3H3
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 3.40E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463415
PNG
(CHEMBL4238830)
Show SMILES Fc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1F
Show InChI InChI=1S/C28H21Cl2F2N7O/c29-17-5-8-19(9-6-17)39-25(20-3-1-2-4-21(20)30)36-24-26(33-16-34-27(24)39)37-11-13-38(14-12-37)28(40)35-18-7-10-22(31)23(32)15-18/h1-10,15-16H,11-14H2,(H,35,40)
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 4.20E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463420
PNG
(CHEMBL4237503)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)OCC1CCC1)-c1ccccc1Cl
Show InChI InChI=1S/C27H26Cl2N6O2/c28-19-8-10-20(11-9-19)35-24(21-6-1-2-7-22(21)29)32-23-25(30-17-31-26(23)35)33-12-14-34(15-13-33)27(36)37-16-18-4-3-5-18/h1-2,6-11,17-18H,3-5,12-16H2
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 4.60E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463422
PNG
(CHEMBL4248778)
Show SMILES CC(C)(C)CC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C27H28Cl2N6O/c1-27(2,3)16-22(36)33-12-14-34(15-13-33)25-23-26(31-17-30-25)35(19-10-8-18(28)9-11-19)24(32-23)20-6-4-5-7-21(20)29/h4-11,17H,12-16H2,1-3H3
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 5.00E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463424
PNG
(CHEMBL4239666)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)CN1CCCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H29Cl2N7O/c29-20-8-10-21(11-9-20)37-26(22-6-2-3-7-23(22)30)33-25-27(31-19-32-28(25)37)36-16-14-35(15-17-36)24(38)18-34-12-4-1-5-13-34/h2-3,6-11,19H,1,4-5,12-18H2
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 5.00E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463427
PNG
(CHEMBL4241316)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccccn1)-c1ccccc1Cl
Show InChI InChI=1S/C27H22Cl2N8O/c28-18-8-10-19(11-9-18)37-24(20-5-1-2-6-21(20)29)34-23-25(31-17-32-26(23)37)35-13-15-36(16-14-35)27(38)33-22-7-3-4-12-30-22/h1-12,17H,13-16H2,(H,30,33,38)
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 7.10E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(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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 7.70E+3n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463421
PNG
(CHEMBL4238299)
Show SMILES CCOCC(=O)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H24Cl2N6O2/c1-2-35-15-21(34)31-11-13-32(14-12-31)24-22-25(29-16-28-24)33(18-9-7-17(26)8-10-18)23(30-22)19-5-3-4-6-20(19)27/h3-10,16H,2,11-15H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463401
PNG
(CHEMBL4242565)
Show SMILES FC(F)Oc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cn1
Show InChI InChI=1S/C28H22Cl2F2N8O2/c29-17-5-8-19(9-6-17)40-24(20-3-1-2-4-21(20)30)37-23-25(34-16-35-26(23)40)38-11-13-39(14-12-38)28(41)36-18-7-10-22(33-15-18)42-27(31)32/h1-10,15-16,27H,11-14H2,(H,36,41)
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>1.00E+4n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50463404
PNG
(CHEMBL4244751)
Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)CC1CCCC1)-c1ccccc1Cl
Show InChI InChI=1S/C28H28Cl2N6O/c29-20-9-11-21(12-10-20)36-26(22-7-3-4-8-23(22)30)33-25-27(31-18-32-28(25)36)35-15-13-34(14-16-35)24(37)17-19-5-1-2-6-19/h3-4,7-12,18-19H,1-2,5-6,13-17H2
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>1.00E+4n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cell membranes after 1 hr by liquid scintillation spectrometry

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50463401
PNG
(CHEMBL4242565)
Show SMILES FC(F)Oc1ccc(NC(=O)N2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cn1
Show InChI InChI=1S/C28H22Cl2F2N8O2/c29-17-5-8-19(9-6-17)40-24(20-3-1-2-4-21(20)30)37-23-25(34-16-35-26(23)40)38-11-13-39(14-12-38)28(41)36-18-7-10-22(33-15-18)42-27(31)32/h1-10,15-16,27H,11-14H2,(H,36,41)
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n/an/an/an/a 590n/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB1 receptor expressed in HEK293 cells co-expressing Galphaq16 assessed as inhibition of calcium mobilization after...

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
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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n/an/an/an/a 586n/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB1 receptor expressed in HEK293 cells co-expressing Galphaq16 assessed as inhibition of calcium mobilization after...

Bioorg Med Chem 26: 4518-4531 (2018)


Article DOI: 10.1016/j.bmc.2018.07.043
BindingDB Entry DOI: 10.7270/Q2VM4FW4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%