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PubMed code 26203658

Compile data set for download or QSAR
Found 39 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))
BDBM50095949
PNG
(CHEMBL3590378)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)OCCc1ccc(NC)cc1
Show InChI InChI=1S/C19H19N7O4/c1-2-22-18(29)15-13(27)14(28)19(30-15)26-9-23-12-16(20)24-11(25-17(12)26)4-3-10-5-7-21-8-6-10/h5-9,13-15,19,27-28H,2H2,1H3,(H,22,29)(H2,20,24,25)/t13-,14+,15+,19?/m1/s1
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n/an/an/an/a<1.00E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389934
PNG
(CHEMBL2071070)
Show SMILES CCc1c([nH]c2ccccc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H29N3O/c1-2-20-21-8-4-5-9-22(21)26-23(20)24(28)25-15-14-18-10-12-19(13-11-18)27-16-6-3-7-17-27/h4-5,8-13,26H,2-3,6-7,14-17H2,1H3,(H,25,28)
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n/an/an/an/a 4.01E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389932
PNG
(CHEMBL2071068)
Show SMILES CC(O)c1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O2/c1-16(29)22-20-15-18(25)7-10-21(20)27-23(22)24(30)26-12-11-17-5-8-19(9-6-17)28-13-3-2-4-14-28/h5-10,15-16,27,29H,2-4,11-14H2,1H3,(H,26,30)
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n/an/an/an/a 1.51E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50095949
PNG
(CHEMBL3590378)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)OCCc1ccc(NC)cc1
Show InChI InChI=1S/C19H19N7O4/c1-2-22-18(29)15-13(27)14(28)19(30-15)26-9-23-12-16(20)24-11(25-17(12)26)4-3-10-5-7-21-8-6-10/h5-9,13-15,19,27-28H,2H2,1H3,(H,22,29)(H2,20,24,25)/t13-,14+,15+,19?/m1/s1
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n/an/an/an/a<1.00E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389934
PNG
(CHEMBL2071070)
Show SMILES CCc1c([nH]c2ccccc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H29N3O/c1-2-20-21-8-4-5-9-22(21)26-23(20)24(28)25-15-14-18-10-12-19(13-11-18)27-16-6-3-7-17-27/h4-5,8-13,26H,2-3,6-7,14-17H2,1H3,(H,25,28)
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n/an/an/an/a 2.99E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389930
PNG
(CHEMBL2071065)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C19H18Cl2N2O/c1-2-15-16-11-14(21)7-8-17(16)23-18(15)19(24)22-10-9-12-3-5-13(20)6-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 8.18E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389931
PNG
(CHEMBL2071066)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(F)cc1
Show InChI InChI=1S/C19H18ClFN2O/c1-2-15-16-11-13(20)5-8-17(16)23-18(15)19(24)22-10-9-12-3-6-14(21)7-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 4.58E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389925
PNG
(CHEMBL2071060)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C19H18ClN3O3/c1-2-15-16-11-13(20)5-8-17(16)22-18(15)19(24)21-10-9-12-3-6-14(7-4-12)23(25)26/h3-8,11,22H,2,9-10H2,1H3,(H,21,24)
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n/an/an/an/a 3.59E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389928
PNG
(CHEMBL2071063)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N(C)C
Show InChI InChI=1S/C21H24ClN3O/c1-4-17-18-13-15(22)7-10-19(18)24-20(17)21(26)23-12-11-14-5-8-16(9-6-14)25(2)3/h5-10,13,24H,4,11-12H2,1-3H3,(H,23,26)
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n/an/an/an/a 430n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389939
PNG
(CHEMBL1553629)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O/c1-2-20-21-16-18(25)8-11-22(21)27-23(20)24(29)26-13-12-17-6-9-19(10-7-17)28-14-4-3-5-15-28/h6-11,16,27H,2-5,12-15H2,1H3,(H,26,29)
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n/an/an/an/a 640n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389925
PNG
(CHEMBL2071060)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C19H18ClN3O3/c1-2-15-16-11-13(20)5-8-17(16)22-18(15)19(24)21-10-9-12-3-6-14(7-4-12)23(25)26/h3-8,11,22H,2,9-10H2,1H3,(H,21,24)
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n/an/an/an/a 660n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB2 receptor expressed in HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation in absenc...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389925
PNG
(CHEMBL2071060)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C19H18ClN3O3/c1-2-15-16-11-13(20)5-8-17(16)22-18(15)19(24)21-10-9-12-3-6-14(7-4-12)23(25)26/h3-8,11,22H,2,9-10H2,1H3,(H,21,24)
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n/an/an/an/a 1.14E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
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 0.576n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389931
PNG
(CHEMBL2071066)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(F)cc1
Show InChI InChI=1S/C19H18ClFN2O/c1-2-15-16-11-13(20)5-8-17(16)23-18(15)19(24)22-10-9-12-3-6-14(21)7-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 7.37E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(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 0.437n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389939
PNG
(CHEMBL1553629)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O/c1-2-20-21-16-18(25)8-11-22(21)27-23(20)24(29)26-13-12-17-6-9-19(10-7-17)28-14-4-3-5-15-28/h6-11,16,27H,2-5,12-15H2,1H3,(H,26,29)
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n/an/an/an/a 2.09E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389930
PNG
(CHEMBL2071065)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C19H18Cl2N2O/c1-2-15-16-11-14(21)7-8-17(16)23-18(15)19(24)22-10-9-12-3-5-13(20)6-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 2.00E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389930
PNG
(CHEMBL2071065)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C19H18Cl2N2O/c1-2-15-16-11-14(21)7-8-17(16)23-18(15)19(24)22-10-9-12-3-5-13(20)6-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 1.84E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389939
PNG
(CHEMBL1553629)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O/c1-2-20-21-16-18(25)8-11-22(21)27-23(20)24(29)26-13-12-17-6-9-19(10-7-17)28-14-4-3-5-15-28/h6-11,16,27H,2-5,12-15H2,1H3,(H,26,29)
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n/an/an/an/a 2.24E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389939
PNG
(CHEMBL1553629)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O/c1-2-20-21-16-18(25)8-11-22(21)27-23(20)24(29)26-13-12-17-6-9-19(10-7-17)28-14-4-3-5-15-28/h6-11,16,27H,2-5,12-15H2,1H3,(H,26,29)
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n/an/an/an/a 1.06E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389931
PNG
(CHEMBL2071066)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(F)cc1
Show InChI InChI=1S/C19H18ClFN2O/c1-2-15-16-11-13(20)5-8-17(16)23-18(15)19(24)22-10-9-12-3-6-14(21)7-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 4.99E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389928
PNG
(CHEMBL2071063)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N(C)C
Show InChI InChI=1S/C21H24ClN3O/c1-4-17-18-13-15(22)7-10-19(18)24-20(17)21(26)23-12-11-14-5-8-16(9-6-14)25(2)3/h5-10,13,24H,4,11-12H2,1-3H3,(H,23,26)
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n/an/an/an/a 3.43E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389928
PNG
(CHEMBL2071063)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N(C)C
Show InChI InChI=1S/C21H24ClN3O/c1-4-17-18-13-15(22)7-10-19(18)24-20(17)21(26)23-12-11-14-5-8-16(9-6-14)25(2)3/h5-10,13,24H,4,11-12H2,1-3H3,(H,23,26)
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n/an/an/an/a 210n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in HEK cells assessed as inhibition of forskolin-induced cAMP accumulation


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389929
PNG
(CHEMBL2071064)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1
Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)
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n/an/an/an/a 790n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389930
PNG
(CHEMBL2071065)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(Cl)cc1
Show InChI InChI=1S/C19H18Cl2N2O/c1-2-15-16-11-14(21)7-8-17(16)23-18(15)19(24)22-10-9-12-3-5-13(20)6-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 3.42E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389925
PNG
(CHEMBL2071060)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C19H18ClN3O3/c1-2-15-16-11-13(20)5-8-17(16)22-18(15)19(24)21-10-9-12-3-6-14(7-4-12)23(25)26/h3-8,11,22H,2,9-10H2,1H3,(H,21,24)
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n/an/an/an/a 440n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in HEK cells assessed as inhibition of forskolin-induced cAMP accumulation


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50095949
PNG
(CHEMBL3590378)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)OCCc1ccc(NC)cc1
Show InChI InChI=1S/C19H19N7O4/c1-2-22-18(29)15-13(27)14(28)19(30-15)26-9-23-12-16(20)24-11(25-17(12)26)4-3-10-5-7-21-8-6-10/h5-9,13-15,19,27-28H,2H2,1H3,(H,22,29)(H2,20,24,25)/t13-,14+,15+,19?/m1/s1
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n/an/an/an/a<1.00E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50389940
PNG
(CHEMBL2071055)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)OCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H27ClN2O2/c1-2-20-21-16-18(25)8-11-22(21)26-23(20)24(28)29-15-12-17-6-9-19(10-7-17)27-13-4-3-5-14-27/h6-11,16,26H,2-5,12-15H2,1H3
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n/an/an/an/a 130n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389934
PNG
(CHEMBL2071070)
Show SMILES CCc1c([nH]c2ccccc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H29N3O/c1-2-20-21-8-4-5-9-22(21)26-23(20)24(28)25-15-14-18-10-12-19(13-11-18)27-16-6-3-7-17-27/h4-5,8-13,26H,2-3,6-7,14-17H2,1H3,(H,25,28)
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n/an/an/an/a 3.55E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50095949
PNG
(CHEMBL3590378)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)OCCc1ccc(NC)cc1
Show InChI InChI=1S/C19H19N7O4/c1-2-22-18(29)15-13(27)14(28)19(30-15)26-9-23-12-16(20)24-11(25-17(12)26)4-3-10-5-7-21-8-6-10/h5-9,13-15,19,27-28H,2H2,1H3,(H,22,29)(H2,20,24,25)/t13-,14+,15+,19?/m1/s1
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n/an/an/an/a<1.00E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389932
PNG
(CHEMBL2071068)
Show SMILES CC(O)c1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O2/c1-16(29)22-20-15-18(25)7-10-21(20)27-23(22)24(30)26-12-11-17-5-8-19(9-6-17)28-13-3-2-4-14-28/h5-10,15-16,27,29H,2-4,11-14H2,1H3,(H,26,30)
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n/an/an/an/a 2.97E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389929
PNG
(CHEMBL2071064)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1
Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)
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n/an/an/an/a 1.01E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389932
PNG
(CHEMBL2071068)
Show SMILES CC(O)c1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O2/c1-16(29)22-20-15-18(25)7-10-21(20)27-23(22)24(30)26-12-11-17-5-8-19(9-6-17)28-13-3-2-4-14-28/h5-10,15-16,27,29H,2-4,11-14H2,1H3,(H,26,30)
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n/an/an/an/a 1.34E+4n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389928
PNG
(CHEMBL2071063)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N(C)C
Show InChI InChI=1S/C21H24ClN3O/c1-4-17-18-13-15(22)7-10-19(18)24-20(17)21(26)23-12-11-14-5-8-16(9-6-14)25(2)3/h5-10,13,24H,4,11-12H2,1-3H3,(H,23,26)
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n/an/an/an/a 600n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389932
PNG
(CHEMBL2071068)
Show SMILES CC(O)c1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H28ClN3O2/c1-16(29)22-20-15-18(25)7-10-21(20)27-23(22)24(30)26-12-11-17-5-8-19(9-6-17)28-13-3-2-4-14-28/h5-10,15-16,27,29H,2-4,11-14H2,1H3,(H,26,30)
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n/an/an/an/a 2.66E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389931
PNG
(CHEMBL2071066)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(F)cc1
Show InChI InChI=1S/C19H18ClFN2O/c1-2-15-16-11-13(20)5-8-17(16)23-18(15)19(24)22-10-9-12-3-6-14(21)7-4-12/h3-8,11,23H,2,9-10H2,1H3,(H,22,24)
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n/an/an/an/a 8.96E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 5 mins ...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389934
PNG
(CHEMBL2071070)
Show SMILES CCc1c([nH]c2ccccc12)C(=O)NCCc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H29N3O/c1-2-20-21-8-4-5-9-22(21)26-23(20)24(28)25-15-14-18-10-12-19(13-11-18)27-16-6-3-7-17-27/h4-5,8-13,26H,2-3,6-7,14-17H2,1H3,(H,25,28)
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n/an/an/an/a 6.84E+3n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389929
PNG
(CHEMBL2071064)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1
Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)
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n/an/an/an/a 600n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50389929
PNG
(CHEMBL2071064)
Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1
Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)
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n/an/an/an/a 470n/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...


J Med Chem 58: 5979-88 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00579
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%