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Compile Data Set for Download or QSAR

Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50045355   
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)
BDBM50058435
PNG
(CHEMBL3331463)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCCCC2)s1
Show InChI InChI=1S/C22H22Cl2N4OS/c1-13-10-15-19(30-13)12-16-20(22(29)26-27-8-4-2-3-5-9-27)25-28(21(15)16)18-7-6-14(23)11-17(18)24/h6-7,10-11H,2-5,8-9,12H2,1H3,(H,26,29)
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1.10n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058436
PNG
(CHEMBL3331464)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCCC2)s1
Show InChI InChI=1S/C21H20Cl2N4OS/c1-12-9-14-18(29-12)11-15-19(21(28)25-26-7-3-2-4-8-26)24-27(20(14)15)17-6-5-13(22)10-16(17)23/h5-6,9-10H,2-4,7-8,11H2,1H3,(H,25,28)
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2.30n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058437
PNG
(CHEMBL3329245)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NC1[C@@]2(C)CCC(C2)C1(C)C |r,TLB:22:23:29:27.26|
Show InChI InChI=1S/C28H33N3OS/c1-16-6-8-18(9-7-16)14-31-24-20(12-21-22(24)17(2)15-33-21)23(30-31)25(32)29-26-27(3,4)19-10-11-28(26,5)13-19/h6-9,15,19,26H,10-14H2,1-5H3,(H,29,32)/t19?,26?,28-/m0/s1
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2.40n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058438
PNG
(CHEMBL3329244)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(Cc2ccc(C)cc2)c-2c1Cc1scc(C)c-21 |r|
Show InChI InChI=1S/C28H35N3OS/c1-16(2)21-11-8-18(4)12-23(21)29-28(32)26-22-13-24-25(19(5)15-33-24)27(22)31(30-26)14-20-9-6-17(3)7-10-20/h6-7,9-10,15-16,18,21,23H,8,11-14H2,1-5H3,(H,29,32)/t18-,21+,23?/m0/s1
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2.70n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058500
PNG
(CHEMBL3331452)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(Cc2ccc(C)cc2)c-2c1Cc1sc(C)cc-21 |r|
Show InChI InChI=1S/C28H35N3OS/c1-16(2)21-11-8-18(4)12-24(21)29-28(32)26-23-14-25-22(13-19(5)33-25)27(23)31(30-26)15-20-9-6-17(3)7-10-20/h6-7,9-10,13,16,18,21,24H,8,11-12,14-15H2,1-5H3,(H,29,32)/t18-,21+,24?/m0/s1
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4.80n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058508
PNG
(CHEMBL3331460)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(c-2c1Cc1sc(C)cc-21)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C26H29Cl2N3OS/c1-13(2)17-7-5-14(3)9-21(17)29-26(32)24-19-12-23-18(10-15(4)33-23)25(19)31(30-24)22-8-6-16(27)11-20(22)28/h6,8,10-11,13-14,17,21H,5,7,9,12H2,1-4H3,(H,29,32)/t14-,17+,21?/m0/s1
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5.10n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058501
PNG
(CHEMBL3331453)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NC1[C@@]2(C)CCC(C2)C1(C)C |r,THB:22:23:26.27:29|
Show InChI InChI=1S/C26H27Cl2N3OS/c1-13-12-33-19-10-16-21(23(32)29-24-25(2,3)14-7-8-26(24,4)11-14)30-31(22(16)20(13)19)18-6-5-15(27)9-17(18)28/h5-6,9,12,14,24H,7-8,10-11H2,1-4H3,(H,29,32)/t14?,24?,26-/m0/s1
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5.30n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058508
PNG
(CHEMBL3331460)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(c-2c1Cc1sc(C)cc-21)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C26H29Cl2N3OS/c1-13(2)17-7-5-14(3)9-21(17)29-26(32)24-19-12-23-18(10-15(4)33-23)25(19)31(30-24)22-8-6-16(27)11-20(22)28/h6,8,10-11,13-14,17,21H,5,7,9,12H2,1-4H3,(H,29,32)/t14-,17+,21?/m0/s1
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6.5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058502
PNG
(CHEMBL3331454)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(c-2c1Cc1scc(C)c-21)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C26H29Cl2N3OS/c1-13(2)17-7-5-14(3)9-20(17)29-26(32)24-18-11-22-23(15(4)12-33-22)25(18)31(30-24)21-8-6-16(27)10-19(21)28/h6,8,10,12-14,17,20H,5,7,9,11H2,1-4H3,(H,29,32)/t14-,17+,20?/m0/s1
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6.70n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058433
PNG
(CHEMBL3331461)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NC2CCCCC2)s1
Show InChI InChI=1S/C22H21Cl2N3OS/c1-12-9-15-19(29-12)11-16-20(22(28)25-14-5-3-2-4-6-14)26-27(21(15)16)18-8-7-13(23)10-17(18)24/h7-10,14H,2-6,11H2,1H3,(H,25,28)
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7.20n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058434
PNG
(CHEMBL3331462)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCC2)s1
Show InChI InChI=1S/C20H18Cl2N4OS/c1-11-8-13-17(28-11)10-14-18(20(27)24-25-6-2-3-7-25)23-26(19(13)14)16-5-4-12(21)9-15(16)22/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,24,27)
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38n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058498
PNG
(CHEMBL3331450)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCCCCC1
Show InChI InChI=1S/C24H28N4OS/c1-16-7-9-18(10-8-16)14-28-23-19(13-20-21(23)17(2)15-30-20)22(25-28)24(29)26-27-11-5-3-4-6-12-27/h7-10,15H,3-6,11-14H2,1-2H3,(H,26,29)
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69n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058499
PNG
(CHEMBL3331451)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCCCC1
Show InChI InChI=1S/C23H26N4OS/c1-15-6-8-17(9-7-15)13-27-22-18(12-19-20(22)16(2)14-29-19)21(24-27)23(28)25-26-10-4-3-5-11-26/h6-9,14H,3-5,10-13H2,1-2H3,(H,25,28)
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125n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058438
PNG
(CHEMBL3329244)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(Cc2ccc(C)cc2)c-2c1Cc1scc(C)c-21 |r|
Show InChI InChI=1S/C28H35N3OS/c1-16(2)21-11-8-18(4)12-23(21)29-28(32)26-22-13-24-25(19(5)15-33-24)27(22)31(30-26)14-20-9-6-17(3)7-10-20/h6-7,9-10,15-16,18,21,23H,8,11-14H2,1-5H3,(H,29,32)/t18-,21+,23?/m0/s1
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160n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058500
PNG
(CHEMBL3331452)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(Cc2ccc(C)cc2)c-2c1Cc1sc(C)cc-21 |r|
Show InChI InChI=1S/C28H35N3OS/c1-16(2)21-11-8-18(4)12-24(21)29-28(32)26-23-14-25-22(13-19(5)33-25)27(23)31(30-26)15-20-9-6-17(3)7-10-20/h6-7,9-10,13,16,18,21,24H,8,11-12,14-15H2,1-5H3,(H,29,32)/t18-,21+,24?/m0/s1
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180n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058496
PNG
(CHEMBL3331448)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H27N3OS/c1-15-8-10-17(11-9-15)13-27-23-19(12-20-21(23)16(2)14-29-20)22(26-27)24(28)25-18-6-4-3-5-7-18/h8-11,14,18H,3-7,12-13H2,1-2H3,(H,25,28)
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191n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058506
PNG
(CHEMBL3331458)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCCC1
Show InChI InChI=1S/C22H22Cl2N4OS/c1-13-12-30-18-11-15-20(22(29)26-27-8-4-2-3-5-9-27)25-28(21(15)19(13)18)17-7-6-14(23)10-16(17)24/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,26,29)
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321n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058499
PNG
(CHEMBL3331451)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCCCC1
Show InChI InChI=1S/C23H26N4OS/c1-15-6-8-17(9-7-15)13-27-22-18(12-19-20(22)16(2)14-29-19)21(24-27)23(28)25-26-10-4-3-5-11-26/h6-9,14H,3-5,10-13H2,1-2H3,(H,25,28)
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377n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058437
PNG
(CHEMBL3329245)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NC1[C@@]2(C)CCC(C2)C1(C)C |r,TLB:22:23:29:27.26|
Show InChI InChI=1S/C28H33N3OS/c1-16-6-8-18(9-7-16)14-31-24-20(12-21-22(24)17(2)15-33-21)23(30-31)25(32)29-26-27(3,4)19-10-11-28(26,5)13-19/h6-9,15,19,26H,10-14H2,1-5H3,(H,29,32)/t19?,26?,28-/m0/s1
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420n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058436
PNG
(CHEMBL3331464)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCCC2)s1
Show InChI InChI=1S/C21H20Cl2N4OS/c1-12-9-14-18(29-12)11-15-19(21(28)25-26-7-3-2-4-8-26)24-27(20(14)15)17-6-5-13(22)10-16(17)23/h5-6,9-10H,2-4,7-8,11H2,1H3,(H,25,28)
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440n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058435
PNG
(CHEMBL3331463)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCCCC2)s1
Show InChI InChI=1S/C22H22Cl2N4OS/c1-13-10-15-19(30-13)12-16-20(22(29)26-27-8-4-2-3-5-9-27)25-28(21(15)16)18-7-6-14(23)11-17(18)24/h6-7,10-11H,2-5,8-9,12H2,1H3,(H,26,29)
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442n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058433
PNG
(CHEMBL3331461)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NC2CCCCC2)s1
Show InChI InChI=1S/C22H21Cl2N3OS/c1-12-9-15-19(29-12)11-16-20(22(28)25-14-5-3-2-4-6-14)26-27(21(15)16)18-8-7-13(23)10-17(18)24/h7-10,14H,2-6,11H2,1H3,(H,25,28)
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447n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058504
PNG
(CHEMBL3331456)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H21Cl2N3OS/c1-12-11-29-18-10-15-20(22(28)25-14-5-3-2-4-6-14)26-27(21(15)19(12)18)17-8-7-13(23)9-16(17)24/h7-9,11,14H,2-6,10H2,1H3,(H,25,28)
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501n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058497
PNG
(CHEMBL3331449)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCCC1
Show InChI InChI=1S/C22H24N4OS/c1-14-5-7-16(8-6-14)12-26-21-17(11-18-19(21)15(2)13-28-18)20(23-26)22(27)24-25-9-3-4-10-25/h5-8,13H,3-4,9-12H2,1-2H3,(H,24,27)
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515n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058507
PNG
(CHEMBL3331459)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Show InChI InChI=1S/C21H20Cl2N4OS/c1-12-11-29-17-10-14-19(21(28)25-26-7-3-2-4-8-26)24-27(20(14)18(12)17)16-6-5-13(22)9-15(16)23/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,25,28)
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578n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058503
PNG
(CHEMBL3331455)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCOCC1
Show InChI InChI=1S/C20H18Cl2N4O2S/c1-11-10-29-16-9-13-18(20(27)24-25-4-6-28-7-5-25)23-26(19(13)17(11)16)15-3-2-12(21)8-14(15)22/h2-3,8,10H,4-7,9H2,1H3,(H,24,27)
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747n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058505
PNG
(CHEMBL3331457)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCC1
Show InChI InChI=1S/C20H18Cl2N4OS/c1-11-10-28-16-9-13-18(20(27)24-25-6-2-3-7-25)23-26(19(13)17(11)16)15-5-4-12(21)8-14(15)22/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,24,27)
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817n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058498
PNG
(CHEMBL3331450)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCCCCC1
Show InChI InChI=1S/C24H28N4OS/c1-16-7-9-18(10-8-16)14-28-23-19(13-20-21(23)17(2)15-30-20)22(25-28)24(29)26-27-11-5-3-4-6-12-27/h7-10,15H,3-6,11-14H2,1-2H3,(H,26,29)
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1.28E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058434
PNG
(CHEMBL3331462)
Show SMILES Cc1cc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCC2)s1
Show InChI InChI=1S/C20H18Cl2N4OS/c1-11-8-13-17(28-11)10-14-18(20(27)24-25-6-2-3-7-25)23-26(19(13)14)16-5-4-12(21)9-15(16)22/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,24,27)
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1.39E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50058484
PNG
(CHEMBL3331447)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCOCC1
Show InChI InChI=1S/C22H24N4O2S/c1-14-3-5-16(6-4-14)12-26-21-17(11-18-19(21)15(2)13-29-18)20(23-26)22(27)24-25-7-9-28-10-8-25/h3-6,13H,7-12H2,1-2H3,(H,24,27)
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1.76E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse spleen CB2 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058496
PNG
(CHEMBL3331448)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H27N3OS/c1-15-8-10-17(11-9-15)13-27-23-19(12-20-21(23)16(2)14-29-20)22(26-27)24(28)25-18-6-4-3-5-7-18/h8-11,14,18H,3-7,12-13H2,1-2H3,(H,25,28)
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1.98E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058501
PNG
(CHEMBL3331453)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NC1[C@@]2(C)CCC(C2)C1(C)C |r,THB:22:23:26.27:29|
Show InChI InChI=1S/C26H27Cl2N3OS/c1-13-12-33-19-10-16-21(23(32)29-24-25(2,3)14-7-8-26(24,4)11-14)30-31(22(16)20(13)19)18-6-5-15(27)9-17(18)28/h5-6,9,12,14,24H,7-8,10-11H2,1-4H3,(H,29,32)/t14?,24?,26-/m0/s1
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2.25E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058504
PNG
(CHEMBL3331456)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H21Cl2N3OS/c1-12-11-29-18-10-15-20(22(28)25-14-5-3-2-4-6-14)26-27(21(15)19(12)18)17-8-7-13(23)9-16(17)24/h7-9,11,14H,2-6,10H2,1H3,(H,25,28)
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3.08E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058502
PNG
(CHEMBL3331454)
Show SMILES CC(C)[C@H]1CC[C@H](C)CC1NC(=O)c1nn(c-2c1Cc1scc(C)c-21)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C26H29Cl2N3OS/c1-13(2)17-7-5-14(3)9-20(17)29-26(32)24-18-11-22-23(15(4)12-33-22)25(18)31(30-24)21-8-6-16(27)10-19(21)28/h6,8,10,12-14,17,20H,5,7,9,11H2,1-4H3,(H,29,32)/t14-,17+,20?/m0/s1
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3.26E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058506
PNG
(CHEMBL3331458)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCCC1
Show InChI InChI=1S/C22H22Cl2N4OS/c1-13-12-30-18-11-15-20(22(29)26-27-8-4-2-3-5-9-27)25-28(21(15)19(13)18)17-7-6-14(23)10-16(17)24/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,26,29)
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3.80E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058507
PNG
(CHEMBL3331459)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Show InChI InChI=1S/C21H20Cl2N4OS/c1-12-11-29-17-10-14-19(21(28)25-26-7-3-2-4-8-26)24-27(20(14)18(12)17)16-6-5-13(22)9-15(16)23/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,25,28)
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3.92E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058484
PNG
(CHEMBL3331447)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCOCC1
Show InChI InChI=1S/C22H24N4O2S/c1-14-3-5-16(6-4-14)12-26-21-17(11-18-19(21)15(2)13-29-18)20(23-26)22(27)24-25-7-9-28-10-8-25/h3-6,13H,7-12H2,1-2H3,(H,24,27)
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4.50E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058497
PNG
(CHEMBL3331449)
Show SMILES Cc1csc2Cc3c(nn(Cc4ccc(C)cc4)c3-c12)C(=O)NN1CCCC1
Show InChI InChI=1S/C22H24N4OS/c1-14-5-7-16(8-6-14)12-26-21-17(11-18-19(21)15(2)13-28-18)20(23-26)22(27)24-25-9-3-4-10-25/h5-8,13H,3-4,9-12H2,1-2H3,(H,24,27)
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PubMed
4.50E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058503
PNG
(CHEMBL3331455)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCOCC1
Show InChI InChI=1S/C20H18Cl2N4O2S/c1-11-10-29-16-9-13-18(20(27)24-25-4-6-28-7-5-25)23-26(19(13)17(11)16)15-3-2-12(21)8-14(15)22/h2-3,8,10H,4-7,9H2,1H3,(H,24,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
4.71E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Mus musculus (Mouse))
BDBM50058505
PNG
(CHEMBL3331457)
Show SMILES Cc1csc2Cc3c(nn(c3-c12)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCC1
Show InChI InChI=1S/C20H18Cl2N4OS/c1-11-10-28-16-9-13-18(20(27)24-25-6-2-3-7-25)23-26(19(13)17(11)16)15-5-4-12(21)8-14(15)22/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,24,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
4.73E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CD1 mouse brain (minus cerebellum) CB1 receptor by liquid scintillation counting


Eur J Med Chem 85: 747-57 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.042
BindingDB Entry DOI: 10.7270/Q2X068Q0
More data for this
Ligand-Target Pair