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Compile Data Set for Download or QSAR

Found 329 hits with Last Name = 'tius' and Initial = 'ma'   
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


(MOUSE)
BDBM50557516
PNG
(CHEMBL4787347)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=[N+]=[N-])(C3)O1)C2 |r,TLB:24:25:22.23.32:33,28:27:22:34.24.25,THB:24:23:33:34.25.26,26:25:22:32.27.33,26:27:22:34.24.25|
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0.700n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from mouse CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50053265
PNG
((6aR,9R,10aR)-3-((Z)-Hept-1-enyl)-9-hydroxymethyl-...)
Show SMILES CCCCC\C=C/c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H34O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h8-9,13-14,17-19,24-25H,4-7,10-12,15H2,1-3H3/b9-8-/t17-,18-,19-/m1/s1
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0.800n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 1 enriched rat brain microsome prepara...


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50053266
PNG
((6aR,9R,10aR)-3-((E)-Hept-1-enyl)-9-hydroxymethyl-...)
Show SMILES CCCCC\C=C\c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H34O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h8-9,13-14,17-19,24-25H,4-7,10-12,15H2,1-3H3/b9-8+/t17-,18-,19-/m1/s1
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1.20n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 1 enriched rat brain microsome prepara...


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50066705
PNG
((6R,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-6,9-bis-h...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CO)Oc2c1
Show InChI InChI=1S/C25H40O4/c1-5-6-7-8-11-24(2,3)18-13-21(28)23-19-12-17(15-26)9-10-20(19)25(4,16-27)29-22(23)14-18/h13-14,17,19-20,26-28H,5-12,15-16H2,1-4H3/t17-,19-,20-,25+/m1/s1
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1.40n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 2 from mouse spleen was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50557512
PNG
(CHEMBL4779775)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(C3)(O1)C#N)C2 |r,TLB:23:24:21.22.27:28,29:26:21:31.23.24,THB:23:22:28:31.24.25,25:24:21:27.26.28,25:26:21:31.23.24|
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1.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from mouse CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066705
PNG
((6R,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-6,9-bis-h...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CO)Oc2c1
Show InChI InChI=1S/C25H40O4/c1-5-6-7-8-11-24(2,3)18-13-21(28)23-19-12-17(15-26)9-10-20(19)25(4,16-27)29-22(23)14-18/h13-14,17,19-20,26-28H,5-12,15-16H2,1-4H3/t17-,19-,20-,25+/m1/s1
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1.90n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50557516
PNG
(CHEMBL4787347)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=[N+]=[N-])(C3)O1)C2 |r,TLB:24:25:22.23.32:33,28:27:22:34.24.25,THB:24:23:33:34.25.26,26:25:22:32.27.33,26:27:22:34.24.25|
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2n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from rat brain CB1 receptor by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50078762
PNG
(CHEMBL3416121)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@@]12CC3CC(C[C@](C3)(C1)NC(=O)OC)C2 |r,TLB:23:24:21.22.27:28,27:22:34:26.28.25,27:26:34:21.22.23,29:26:34:21.22.23|
Show InChI InChI=1S/C27H37NO5/c1-25(2)20-5-4-18(29)9-19(20)23-21(30)7-17(8-22(23)33-25)26-10-15-6-16(11-26)13-27(12-15,14-26)28-24(31)32-3/h7-8,15-16,18-20,29-30H,4-6,9-14H2,1-3H3,(H,28,31)/t15?,16?,18-,19-,20-,26-,27-/m1/s1
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2.10n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066709
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxy...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCCO)Oc2c1
Show InChI InChI=1S/C27H44O4/c1-5-6-7-8-12-26(2,3)20-16-23(30)25-21-15-19(18-29)10-11-22(21)27(4,13-9-14-28)31-24(25)17-20/h16-17,19,21-22,28-30H,5-15,18H2,1-4H3/t19-,21-,22-,27+/m1/s1
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2.20n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50557516
PNG
(CHEMBL4787347)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=[N+]=[N-])(C3)O1)C2 |r,TLB:24:25:22.23.32:33,28:27:22:34.24.25,THB:24:23:33:34.25.26,26:25:22:32.27.33,26:27:22:34.24.25|
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2.20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066710
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxy...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCCI)Oc2c1
Show InChI InChI=1S/C27H43IO3/c1-5-6-7-8-12-26(2,3)20-16-23(30)25-21-15-19(18-29)10-11-22(21)27(4,13-9-14-28)31-24(25)17-20/h16-17,19,21-22,29-30H,5-15,18H2,1-4H3/t19-,21-,22-,27+/m1/s1
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2.20n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50066712
PNG
((6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxymet...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C25H40O3/c1-6-7-8-9-12-24(2,3)18-14-21(27)23-19-13-17(16-26)10-11-20(19)25(4,5)28-22(23)15-18/h14-15,17,19-20,26-27H,6-13,16H2,1-5H3/t17-,19-,20-/m1/s1
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2.30n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 2 from mouse spleen was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066712
PNG
((6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxymet...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C25H40O3/c1-6-7-8-9-12-24(2,3)18-14-21(27)23-19-13-17(16-26)10-11-20(19)25(4,5)28-22(23)15-18/h14-15,17,19-20,26-27H,6-13,16H2,1-5H3/t17-,19-,20-/m1/s1
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2.30n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50066706
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-6-(2-hydr...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCO)Oc2c1
Show InChI InChI=1S/C26H42O4/c1-5-6-7-8-11-25(2,3)19-15-22(29)24-20-14-18(17-28)9-10-21(20)26(4,12-13-27)30-23(24)16-19/h15-16,18,20-21,27-29H,5-14,17H2,1-4H3/t18-,20-,21-,26+/m1/s1
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2.30n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 2 from mouse spleen was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50557513
PNG
(CHEMBL4795739)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=[N+]=[N-])(C3)O1)C2 |r,TLB:23:24:21.22.31:32,27:26:21:33.23.24,THB:23:22:32:33.24.25,25:24:21:31.26.32,25:26:21:33.23.24|
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2.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from rat brain CB1 receptor by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50078767
PNG
(CHEMBL3416126)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CC#N)(C3)C1)C2 |r,THB:23:22:32.24.25:31,25:24:21:26.31.30,25:26:21:32.24.23,27:26:21:32.24.23|
Show InChI InChI=1S/C27H35NO3/c1-25(2)21-4-3-19(29)10-20(21)24-22(30)8-18(9-23(24)31-25)27-13-16-7-17(14-27)12-26(11-16,15-27)5-6-28/h8-9,16-17,19-21,29-30H,3-5,7,10-15H2,1-2H3/t16?,17?,19-,20-,21-,26-,27+/m1/s1
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2.60n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50557513
PNG
(CHEMBL4795739)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=[N+]=[N-])(C3)O1)C2 |r,TLB:23:24:21.22.31:32,27:26:21:33.23.24,THB:23:22:32:33.24.25,25:24:21:31.26.32,25:26:21:33.23.24|
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2.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from mouse CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50078763
PNG
(CHEMBL3416122)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@@]12CC3CC(C[C@](C3)(C1)C#N)C2 |r,TLB:23:24:21.22.27:28,27:22:31:26.28.25,27:26:31:21.22.23|
Show InChI InChI=1S/C26H33NO3/c1-24(2)20-4-3-18(28)8-19(20)23-21(29)6-17(7-22(23)30-24)26-11-15-5-16(12-26)10-25(9-15,13-26)14-27/h6-7,15-16,18-20,28-29H,3-5,8-13H2,1-2H3/t15?,16?,18-,19-,20-,25-,26-/m1/s1
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2.80n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066706
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-6-(2-hydr...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCO)Oc2c1
Show InChI InChI=1S/C26H42O4/c1-5-6-7-8-11-25(2,3)19-15-22(29)24-20-14-18(17-28)9-10-21(20)26(4,12-13-27)30-23(24)16-19/h15-16,18,20-21,27-29H,5-14,17H2,1-4H3/t18-,20-,21-,26+/m1/s1
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2.80n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50078769
PNG
(CHEMBL3416128)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CN=C=S)(C3)C1)C2 |r,THB:23:22:33.24.25:32,25:24:21:26.32.31,25:26:21:33.24.23,27:26:21:33.24.23|
Show InChI InChI=1S/C27H35NO3S/c1-25(2)21-4-3-19(29)8-20(21)24-22(30)6-18(7-23(24)31-25)27-11-16-5-17(12-27)10-26(9-16,13-27)14-28-15-32/h6-7,16-17,19-21,29-30H,3-5,8-14H2,1-2H3/t16?,17?,19-,20-,21-,26-,27-/m1/s1
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3n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50557513
PNG
(CHEMBL4795739)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=[N+]=[N-])(C3)O1)C2 |r,TLB:23:24:21.22.31:32,27:26:21:33.23.24,THB:23:22:32:33.24.25,25:24:21:31.26.32,25:26:21:33.23.24|
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3.10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50066709
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxy...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCCO)Oc2c1
Show InChI InChI=1S/C27H44O4/c1-5-6-7-8-12-26(2,3)20-16-23(30)25-21-15-19(18-29)10-11-22(21)27(4,13-9-14-28)31-24(25)17-20/h16-17,19,21-22,28-30H,5-15,18H2,1-4H3/t19-,21-,22-,27+/m1/s1
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3.40n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 2 from mouse spleen was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50557514
PNG
(CHEMBL4779296)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=C=S)(C3)O1)C2 |r,TLB:23:24:21.22.31:32,27:26:21:33.23.24,THB:23:22:32:33.24.25,25:24:21:31.26.32,25:26:21:33.23.24|
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3.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50078763
PNG
(CHEMBL3416122)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@@]12CC3CC(C[C@](C3)(C1)C#N)C2 |r,TLB:23:24:21.22.27:28,27:22:31:26.28.25,27:26:31:21.22.23|
Show InChI InChI=1S/C26H33NO3/c1-24(2)20-4-3-18(28)8-19(20)23-21(29)6-17(7-22(23)30-24)26-11-15-5-16(12-26)10-25(9-15,13-26)14-27/h6-7,15-16,18-20,28-29H,3-5,8-13H2,1-2H3/t15?,16?,18-,19-,20-,25-,26-/m1/s1
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4.20n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50066710
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxy...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCCI)Oc2c1
Show InChI InChI=1S/C27H43IO3/c1-5-6-7-8-12-26(2,3)20-16-23(30)25-21-15-19(18-29)10-11-22(21)27(4,13-9-14-28)31-24(25)17-20/h16-17,19,21-22,29-30H,5-15,18H2,1-4H3/t19-,21-,22-,27+/m1/s1
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4.30n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 2 from mouse spleen was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50078770
PNG
(CHEMBL3416129)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CN=[N+]=[N-])(C3)C1)C2 |r,THB:23:22:33.24.25:32,25:24:21:26.32.31,25:26:21:33.24.23,27:26:21:33.24.23|
Show InChI InChI=1S/C26H35N3O3/c1-24(2)20-4-3-18(30)8-19(20)23-21(31)6-17(7-22(23)32-24)26-11-15-5-16(12-26)10-25(9-15,13-26)14-28-29-27/h6-7,15-16,18-20,30-31H,3-5,8-14H2,1-2H3/t15?,16?,18-,19-,20-,25-,26-/m1/s1
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4.40n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50078767
PNG
(CHEMBL3416126)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CC#N)(C3)C1)C2 |r,THB:23:22:32.24.25:31,25:24:21:26.31.30,25:26:21:32.24.23,27:26:21:32.24.23|
Show InChI InChI=1S/C27H35NO3/c1-25(2)21-4-3-19(29)10-20(21)24-22(30)8-18(9-23(24)31-25)27-13-16-7-17(14-27)12-26(11-16,15-27)5-6-28/h8-9,16-17,19-21,29-30H,3-5,7,10-15H2,1-2H3/t16?,17?,19-,20-,21-,26-,27+/m1/s1
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4.40n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50078767
PNG
(CHEMBL3416126)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CC#N)(C3)C1)C2 |r,THB:23:22:32.24.25:31,25:24:21:26.31.30,25:26:21:32.24.23,27:26:21:32.24.23|
Show InChI InChI=1S/C27H35NO3/c1-25(2)21-4-3-19(29)10-20(21)24-22(30)8-18(9-23(24)31-25)27-13-16-7-17(14-27)12-26(11-16,15-27)5-6-28/h8-9,16-17,19-21,29-30H,3-5,7,10-15H2,1-2H3/t16?,17?,19-,20-,21-,26-,27+/m1/s1
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4.60n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50557517
PNG
(CHEMBL4760082)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=C=S)(C3)O1)C2 |r,TLB:24:25:22.23.32:33,28:27:22:34.24.25,THB:24:23:33:34.25.26,26:25:22:32.27.33,26:27:22:34.24.25|
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4.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50557514
PNG
(CHEMBL4779296)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=C=S)(C3)O1)C2 |r,TLB:23:24:21.22.31:32,27:26:21:33.23.24,THB:23:22:32:33.24.25,25:24:21:31.26.32,25:26:21:33.23.24|
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4.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from rat brain CB1 receptor by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50053266
PNG
((6aR,9R,10aR)-3-((E)-Hept-1-enyl)-9-hydroxymethyl-...)
Show SMILES CCCCC\C=C\c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H34O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h8-9,13-14,17-19,24-25H,4-7,10-12,15H2,1-3H3/b9-8+/t17-,18-,19-/m1/s1
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5.30n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 2 enriched mouse spleen preparation.


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50053267
PNG
((6aR,9R,10aR)-3-Hept-1-ynyl-9-hydroxymethyl-6,6-di...)
Show SMILES CCCCCC#Cc1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H32O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h13-14,17-19,24-25H,4-7,10-12,15H2,1-3H3/t17-,18-,19-/m1/s1
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5.80n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 1 enriched rat brain microsome prepara...


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50557517
PNG
(CHEMBL4760082)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=C=S)(C3)O1)C2 |r,TLB:24:25:22.23.32:33,28:27:22:34.24.25,THB:24:23:33:34.25.26,26:25:22:32.27.33,26:27:22:34.24.25|
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6.60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from mouse CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50169951
PNG
((6aR,10aR)-3-Adamantan-1-yl-6,6,9-trimethyl-6a,7,1...)
Show SMILES CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(cc1OC2(C)C)C12CC3CC(CC(C3)C1)C2 |r,t:1,TLB:11:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,11:18:21:25.24.23,26:18:21:25.24.23,26:24:21:27.19.18|
Show InChI InChI=1S/C26H34O2/c1-15-4-5-21-20(6-15)24-22(27)10-19(11-23(24)28-25(21,2)3)26-12-16-7-17(13-26)9-18(8-16)14-26/h4,10-11,16-18,20-21,27H,5-9,12-14H2,1-3H3/t16?,17?,18?,20-,21-,26?/m1/s1
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6.80n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in rat brain


J Med Chem 53: 5656-66 (2010)


Article DOI: 10.1021/jm100390h
BindingDB Entry DOI: 10.7270/Q2XW4K0H
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50078762
PNG
(CHEMBL3416121)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@@]12CC3CC(C[C@](C3)(C1)NC(=O)OC)C2 |r,TLB:23:24:21.22.27:28,27:22:34:26.28.25,27:26:34:21.22.23,29:26:34:21.22.23|
Show InChI InChI=1S/C27H37NO5/c1-25(2)20-5-4-18(29)9-19(20)23-21(30)7-17(8-22(23)33-25)26-10-15-6-16(11-26)13-27(12-15,14-26)28-24(31)32-3/h7-8,15-16,18-20,29-30H,4-6,9-14H2,1-3H3,(H,28,31)/t15?,16?,18-,19-,20-,26-,27-/m1/s1
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8.40n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50557517
PNG
(CHEMBL4760082)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=C=S)(C3)O1)C2 |r,TLB:24:25:22.23.32:33,28:27:22:34.24.25,THB:24:23:33:34.25.26,26:25:22:32.27.33,26:27:22:34.24.25|
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8.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from rat brain CB1 receptor by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50053268
PNG
((6aR,9R,10aR)-3-Heptyl-9-hydroxymethyl-6,6-dimethy...)
Show SMILES CCCCCCCc1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H36O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h13-14,17-19,24-25H,4-12,15H2,1-3H3/t17-,18-,19-/m1/s1
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8.70n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 1 enriched rat brain microsome prepara...


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50557514
PNG
(CHEMBL4779296)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(CN=C=S)(C3)O1)C2 |r,TLB:23:24:21.22.31:32,27:26:21:33.23.24,THB:23:22:32:33.24.25,25:24:21:31.26.32,25:26:21:33.23.24|
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9.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from mouse CB2 receptor expressed in HEK293 cell membrane by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50053265
PNG
((6aR,9R,10aR)-3-((Z)-Hept-1-enyl)-9-hydroxymethyl-...)
Show SMILES CCCCC\C=C/c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H34O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h8-9,13-14,17-19,24-25H,4-7,10-12,15H2,1-3H3/b9-8-/t17-,18-,19-/m1/s1
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9.5n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 2 enriched mouse spleen preparation.


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50078770
PNG
(CHEMBL3416129)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CN=[N+]=[N-])(C3)C1)C2 |r,THB:23:22:33.24.25:32,25:24:21:26.32.31,25:26:21:33.24.23,27:26:21:33.24.23|
Show InChI InChI=1S/C26H35N3O3/c1-24(2)20-4-3-18(30)8-19(20)23-21(31)6-17(7-22(23)32-24)26-11-15-5-16(12-26)10-25(9-15,13-26)14-28-29-27/h6-7,15-16,18-20,30-31H,3-5,8-14H2,1-2H3/t15?,16?,18-,19-,20-,25-,26-/m1/s1
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9.60n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50066708
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxy...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCI)Oc2c1
Show InChI InChI=1S/C26H41IO3/c1-5-6-7-8-11-25(2,3)19-15-22(29)24-20-14-18(17-28)9-10-21(20)26(4,12-13-27)30-23(24)16-19/h15-16,18,20-21,28-29H,5-14,17H2,1-4H3/t18-,20-,21-,26+/m1/s1
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9.70n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 2 from mouse spleen was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50078769
PNG
(CHEMBL3416128)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@]12CC3CC(C[C@@](CN=C=S)(C3)C1)C2 |r,THB:23:22:33.24.25:32,25:24:21:26.32.31,25:26:21:33.24.23,27:26:21:33.24.23|
Show InChI InChI=1S/C27H35NO3S/c1-25(2)21-4-3-19(29)8-20(21)24-22(30)6-18(7-23(24)31-25)27-11-16-5-17(12-27)10-26(9-16,13-27)14-28-15-32/h6-7,16-17,19-21,29-30H,3-5,8-14H2,1-2H3/t16?,17?,19-,20-,21-,26-,27-/m1/s1
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10n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50557515
PNG
(CHEMBL4744219)
Show SMILES [H][C@@]12C[C@H](CO)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C12CC3CC(CC(C3)(O1)C(N)=O)C2 |r,TLB:24:25:22.23.28:29,30:27:22:33.24.25,THB:24:23:29:33.25.26,26:25:22:28.27.29,26:27:22:33.24.25|
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11n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]CP55940 from rat brain CB1 receptor by scintillation counting method


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127882
BindingDB Entry DOI: 10.7270/Q2NP283T
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066707
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-6-ethyl-9...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CC)Oc2c1
Show InChI InChI=1S/C26H42O3/c1-6-8-9-10-13-25(3,4)19-15-22(28)24-20-14-18(17-27)11-12-21(20)26(5,7-2)29-23(24)16-19/h15-16,18,20-21,27-28H,6-14,17H2,1-5H3/t18-,20-,21-,26+/m1/s1
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11.1n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50078765
PNG
(CHEMBL3416124)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@@]12CC3CC(C[C@](C3)(C1)N=C=S)C2 |r,TLB:23:24:21.22.27:28,27:22:32:26.28.25,27:26:32:21.22.23,29:26:32:21.22.23|
Show InChI InChI=1S/C26H33NO3S/c1-24(2)20-4-3-18(28)8-19(20)23-21(29)6-17(7-22(23)30-24)25-9-15-5-16(10-25)12-26(11-15,13-25)27-14-31/h6-7,15-16,18-20,28-29H,3-5,8-13H2,1-2H3/t15?,16?,18-,19-,20-,25-,26-/m1/s1
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13n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50053268
PNG
((6aR,9R,10aR)-3-Heptyl-9-hydroxymethyl-6,6-dimethy...)
Show SMILES CCCCCCCc1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C23H36O3/c1-4-5-6-7-8-9-16-13-20(25)22-18-12-17(15-24)10-11-19(18)23(2,3)26-21(22)14-16/h13-14,17-19,24-25H,4-12,15H2,1-3H3/t17-,18-,19-/m1/s1
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14n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace specifically bound [3H]CP-55940 from a Cannabinoid receptor 2 enriched mouse spleen preparation.


J Med Chem 39: 3790-6 (1996)


Article DOI: 10.1021/jm950934b
BindingDB Entry DOI: 10.7270/Q2TT4RM1
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50066711
PNG
((6S,6aR,9R,10aR)-3-(1,1-Dimethyl-heptyl)-9-hydroxy...)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3C[C@H](CO)CC[C@H]3[C@](C)(CCC)Oc2c1
Show InChI InChI=1S/C27H44O3/c1-6-8-9-10-14-26(3,4)20-16-23(29)25-21-15-19(18-28)11-12-22(21)27(5,13-7-2)30-24(25)17-20/h16-17,19,21-22,28-29H,6-15,18H2,1-5H3/t19-,21-,22-,27+/m1/s1
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14.4n/an/an/an/an/an/an/an/a



University of Hawaii

Curated by ChEMBL


Assay Description
Binding affinity of the compound to Cannabinoid receptor 1 from rat forebrain synaptosomal membranes was measured using [3H]CP-55,940 as radioligand


J Med Chem 41: 3596-608 (1998)


Article DOI: 10.1021/jm960677q
BindingDB Entry DOI: 10.7270/Q26H4GHP
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50323766
PNG
((6aR,9R,10aR)-6,6-Dimethyl-3-(2-oxa-tricyclo[3.3.1...)
Show SMILES CC1(C)Oc2cc(cc(O)c2[C@@H]2C[C@H](O)CC[C@@H]12)C12CC3CC(CC(C3)O1)C2 |r,TLB:21:22:26:19.20.25,6:18:23:20.25.21,27:18:25:22.23.21,THB:21:20:26:27.22.23,6:18:25:22.23.21,27:22:18.26.19:25,19:18:23:20.25.21,19:20:18.26.27:23|
Show InChI InChI=1S/C24H32O4/c1-23(2)19-4-3-16(25)10-18(19)22-20(26)8-15(9-21(22)28-23)24-11-13-5-14(12-24)7-17(6-13)27-24/h8-9,13-14,16-19,25-26H,3-7,10-12H2,1-2H3/t13?,14?,16-,17?,18-,19-,24?/m1/s1
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18n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from mouse CB2 receptor expressed in HEK293 cell membranes


J Med Chem 53: 5656-66 (2010)


Article DOI: 10.1021/jm100390h
BindingDB Entry DOI: 10.7270/Q2XW4K0H
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50078766
PNG
(CHEMBL3416125)
Show SMILES [H][C@@]12C[C@H](O)CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)[C@@]12CC3CC(C[C@](C3)(C1)N=[N+]=[N-])C2 |r,TLB:23:24:21.22.27:28,27:22:32:26.28.25,27:26:32:21.22.23,29:26:32:21.22.23|
Show InChI InChI=1S/C25H33N3O3/c1-23(2)19-4-3-17(29)8-18(19)22-20(30)6-16(7-21(22)31-23)24-9-14-5-15(10-24)12-25(11-14,13-24)27-28-26/h6-7,14-15,17-19,29-30H,3-5,8-13H2,1-2H3/t14?,15?,17-,18-,19-,24-,25-/m1/s1
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19n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain membranes


J Med Chem 58: 3104-16 (2015)


Article DOI: 10.1021/jm501960u
BindingDB Entry DOI: 10.7270/Q22R3TBC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50323766
PNG
((6aR,9R,10aR)-6,6-Dimethyl-3-(2-oxa-tricyclo[3.3.1...)
Show SMILES CC1(C)Oc2cc(cc(O)c2[C@@H]2C[C@H](O)CC[C@@H]12)C12CC3CC(CC(C3)O1)C2 |r,TLB:21:22:26:19.20.25,6:18:23:20.25.21,27:18:25:22.23.21,THB:21:20:26:27.22.23,6:18:25:22.23.21,27:22:18.26.19:25,19:18:23:20.25.21,19:20:18.26.27:23|
Show InChI InChI=1S/C24H32O4/c1-23(2)19-4-3-16(25)10-18(19)22-20(26)8-15(9-21(22)28-23)24-11-13-5-14(12-24)7-17(6-13)27-24/h8-9,13-14,16-19,25-26H,3-7,10-12H2,1-2H3/t13?,14?,16-,17?,18-,19-,24?/m1/s1
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19n/an/an/an/an/an/an/an/a



University of Hawaii at Manoa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB2 receptor expressed in HEK293 cell membranes


J Med Chem 53: 5656-66 (2010)


Article DOI: 10.1021/jm100390h
BindingDB Entry DOI: 10.7270/Q2XW4K0H
More data for this
Ligand-Target Pair
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