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Compile Data Set for Download or QSAR

Found 263 hits with Last Name = 'parkkari' and Initial = 't'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50180022
PNG
(5-(4-chloro-3-methyl-phenyl)-1-(4-methyl-benzyl)-1...)
Show SMILES Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2C3(C)CCC(C3)C2(C)C)cc1
Show InChI InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)
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0.600n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082769
PNG
(CHEMBL3422790)
Show SMILES CC1CCC(CC1)NC(=O)c1c(O)c2cccnc2n(Cc2ccc(F)cc2)c1=O
Show InChI InChI=1S/C23H24FN3O3/c1-14-4-10-17(11-5-14)26-22(29)19-20(28)18-3-2-12-25-21(18)27(23(19)30)13-15-6-8-16(24)9-7-15/h2-3,6-9,12,14,17,28H,4-5,10-11,13H2,1H3,(H,26,29)
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0.75n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082777
PNG
(CHEMBL3422784)
Show SMILES CC1CCC(CC1)NC(=O)c1cc2ccccc2n(Cc2ccc(F)cc2)c1=O
Show InChI InChI=1S/C24H25FN2O2/c1-16-6-12-20(13-7-16)26-23(28)21-14-18-4-2-3-5-22(18)27(24(21)29)15-17-8-10-19(25)11-9-17/h2-5,8-11,14,16,20H,6-7,12-13,15H2,1H3,(H,26,28)
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0.75n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082768
PNG
(CHEMBL3422788)
Show SMILES CCCCCn1c2ccccc2cc(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C22H30N2O2/c1-3-4-7-14-24-20-9-6-5-8-17(20)15-19(22(24)26)21(25)23-18-12-10-16(2)11-13-18/h5-6,8-9,15-16,18H,3-4,7,10-14H2,1-2H3,(H,23,25)
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1.5n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50180036
PNG
((6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetra...)
Show SMILES CCCC(C)(C)c1ccc2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h8-10,14,18-19H,7,11-13H2,1-6H3/t18-,19+/m0/s1
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3n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50180036
PNG
((6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetra...)
Show SMILES CCCC(C)(C)c1ccc2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h8-10,14,18-19H,7,11-13H2,1-6H3/t18-,19+/m0/s1
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3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082776
PNG
(CHEMBL3422785)
Show SMILES CC1CCC(CC1)NC(=O)c1cc2ccccc2n(CCN2CCOCC2)c1=O
Show InChI InChI=1S/C23H31N3O3/c1-17-6-8-19(9-7-17)24-22(27)20-16-18-4-2-3-5-21(18)26(23(20)28)11-10-25-12-14-29-15-13-25/h2-5,16-17,19H,6-15H2,1H3,(H,24,27)
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4.20n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082772
PNG
(CHEMBL3422791)
Show SMILES CC1CCC(CC1)NC(=O)c1c(O)c2cccnc2n(CCN2CCOCC2)c1=O
Show InChI InChI=1S/C22H30N4O4/c1-15-4-6-16(7-5-15)24-21(28)18-19(27)17-3-2-8-23-20(17)26(22(18)29)10-9-25-11-13-30-14-12-25/h2-3,8,15-16,27H,4-7,9-14H2,1H3,(H,24,28)
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7.40n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082771
PNG
(CHEMBL3422792)
Show SMILES CCCCn1c2ncccc2c(O)c(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C20H27N3O3/c1-3-4-12-23-18-15(6-5-11-21-18)17(24)16(20(23)26)19(25)22-14-9-7-13(2)8-10-14/h5-6,11,13-14,24H,3-4,7-10,12H2,1-2H3,(H,22,25)
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11n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062506
PNG
(CHEMBL3397520)
Show SMILES CCCCc1cc(cc(C(=O)NC2CCCCCC2)c1OC)-c1ccc(OC)cc1
Show InChI InChI=1S/C26H35NO3/c1-4-5-10-20-17-21(19-13-15-23(29-2)16-14-19)18-24(25(20)30-3)26(28)27-22-11-8-6-7-9-12-22/h13-18,22H,4-12H2,1-3H3,(H,27,28)
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11n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cell membranes by [35S]GTPgammaS binding assay


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082777
PNG
(CHEMBL3422784)
Show SMILES CC1CCC(CC1)NC(=O)c1cc2ccccc2n(Cc2ccc(F)cc2)c1=O
Show InChI InChI=1S/C24H25FN2O2/c1-16-6-12-20(13-7-16)26-23(28)21-14-18-4-2-3-5-22(18)27(24(21)29)15-17-8-10-19(25)11-9-17/h2-5,8-11,14,16,20H,6-7,12-13,15H2,1H3,(H,26,28)
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19n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082774
PNG
(CHEMBL3422787)
Show SMILES CCCCn1c2ccccc2cc(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C21H28N2O2/c1-3-4-13-23-19-8-6-5-7-16(19)14-18(21(23)25)20(24)22-17-11-9-15(2)10-12-17/h5-8,14-15,17H,3-4,9-13H2,1-2H3,(H,22,24)
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20n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062508
PNG
(CHEMBL3397522)
Show SMILES CCCCc1cc(cc(C(=O)N[C@@H]2CC[C@H](C)CC2)c1OC)-c1ccc(OC)cc1
Show InChI InChI=1/C26H35NO3/c1-5-6-7-20-16-21(19-10-14-23(29-3)15-11-19)17-24(25(20)30-4)26(28)27-22-12-8-18(2)9-13-22/h10-11,14-18,22H,5-9,12-13H2,1-4H3,(H,27,28)/t18-,22+
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22n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082775
PNG
(CHEMBL3422786)
Show SMILES CCCn1c2ccccc2cc(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C20H26N2O2/c1-3-12-22-18-7-5-4-6-15(18)13-17(20(22)24)19(23)21-16-10-8-14(2)9-11-16/h4-7,13-14,16H,3,8-12H2,1-2H3,(H,21,23)
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25n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082773
PNG
(CHEMBL3422789)
Show SMILES CC1CCC(CC1)NC(=O)c1cc2ccccc2n(CCCO)c1=O
Show InChI InChI=1S/C20H26N2O3/c1-14-7-9-16(10-8-14)21-19(24)17-13-15-5-2-3-6-18(15)22(20(17)25)11-4-12-23/h2-3,5-6,13-14,16,23H,4,7-12H2,1H3,(H,21,24)
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36n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062502
PNG
(CHEMBL3397517)
Show SMILES COc1c(C)cc(cc1C(=O)NC1CCCCCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H26FNO2/c1-15-13-17(16-9-11-18(23)12-10-16)14-20(21(15)26-2)22(25)24-19-7-5-3-4-6-8-19/h9-14,19H,3-8H2,1-2H3,(H,24,25)
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60n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062505
PNG
(CHEMBL3397519)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@@H]1CC[C@H](C)CC1)-c1ccc(F)cc1
Show InChI InChI=1/C22H26FNO2/c1-14-4-10-19(11-5-14)24-22(25)20-13-17(12-15(2)21(20)26-3)16-6-8-18(23)9-7-16/h6-9,12-14,19H,4-5,10-11H2,1-3H3,(H,24,25)/t14-,19+
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60n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062504
PNG
(CHEMBL3397518)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@H]1CC[C@H](C)CC1)-c1ccc(F)cc1
Show InChI InChI=1/C22H26FNO2/c1-14-4-10-19(11-5-14)24-22(25)20-13-17(12-15(2)21(20)26-3)16-6-8-18(23)9-7-16/h6-9,12-14,19H,4-5,10-11H2,1-3H3,(H,24,25)/t14-,19-
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90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062499
PNG
(CHEMBL3397449)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@H]1CC[C@H](C)CC1)-c1ccccc1
Show InChI InChI=1/C22H27NO2/c1-15-9-11-19(12-10-15)23-22(24)20-14-18(13-16(2)21(20)25-3)17-7-5-4-6-8-17/h4-8,13-15,19H,9-12H2,1-3H3,(H,23,24)/t15-,19-
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90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062498
PNG
(CHEMBL3397448)
Show SMILES COc1c(C)cc(cc1C(=O)NC1CCCCCC1)-c1ccccc1
Show InChI InChI=1S/C22H27NO2/c1-16-14-18(17-10-6-5-7-11-17)15-20(21(16)25-2)22(24)23-19-12-8-3-4-9-13-19/h5-7,10-11,14-15,19H,3-4,8-9,12-13H2,1-2H3,(H,23,24)
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100n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082769
PNG
(CHEMBL3422790)
Show SMILES CC1CCC(CC1)NC(=O)c1c(O)c2cccnc2n(Cc2ccc(F)cc2)c1=O
Show InChI InChI=1S/C23H24FN3O3/c1-14-4-10-17(11-5-14)26-22(29)19-20(28)18-3-2-12-25-21(18)27(23(19)30)13-15-6-8-16(24)9-7-15/h2-3,6-9,12,14,17,28H,4-5,10-11,13H2,1H3,(H,26,29)
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139n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062507
PNG
(CHEMBL3397521)
Show SMILES CCCCc1cc(cc(C(=O)N[C@H]2CC[C@H](C)CC2)c1OC)-c1ccc(OC)cc1
Show InChI InChI=1/C26H35NO3/c1-5-6-7-20-16-21(19-10-14-23(29-3)15-11-19)17-24(25(20)30-4)26(28)27-22-12-8-18(2)9-13-22/h10-11,14-18,22H,5-9,12-13H2,1-4H3,(H,27,28)/t18-,22-
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143n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062501
PNG
(CHEMBL3397450)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@@H]1CC[C@H](C)CC1)-c1ccccc1
Show InChI InChI=1/C22H27NO2/c1-15-9-11-19(12-10-15)23-22(24)20-14-18(13-16(2)21(20)25-3)17-7-5-4-6-8-17/h4-8,13-15,19H,9-12H2,1-3H3,(H,23,24)/t15-,19+
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150n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062502
PNG
(CHEMBL3397517)
Show SMILES COc1c(C)cc(cc1C(=O)NC1CCCCCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H26FNO2/c1-15-13-17(16-9-11-18(23)12-10-16)14-20(21(15)26-2)22(25)24-19-7-5-3-4-6-8-19/h9-14,19H,3-8H2,1-2H3,(H,24,25)
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160n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062505
PNG
(CHEMBL3397519)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@@H]1CC[C@H](C)CC1)-c1ccc(F)cc1
Show InChI InChI=1/C22H26FNO2/c1-14-4-10-19(11-5-14)24-22(25)20-13-17(12-15(2)21(20)26-3)16-6-8-18(23)9-7-16/h6-9,12-14,19H,4-5,10-11H2,1-3H3,(H,24,25)/t14-,19+
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180n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50082770
PNG
(CHEMBL3422793)
Show SMILES CC1CCC(CC1)NC(=O)c1c(O)c2cccnc2n(CCCO)c1=O
Show InChI InChI=1S/C19H25N3O4/c1-12-5-7-13(8-6-12)21-18(25)15-16(24)14-4-2-9-20-17(14)22(19(15)26)10-3-11-23/h2,4,9,12-13,23-24H,3,5-8,10-11H2,1H3,(H,21,25)
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215n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB2 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082768
PNG
(CHEMBL3422788)
Show SMILES CCCCCn1c2ccccc2cc(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C22H30N2O2/c1-3-4-7-14-24-20-9-6-5-8-17(20)15-19(22(24)26)21(25)23-18-12-10-16(2)11-13-18/h5-6,8-9,15-16,18H,3-4,7,10-14H2,1-2H3,(H,23,25)
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227n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50180022
PNG
(5-(4-chloro-3-methyl-phenyl)-1-(4-methyl-benzyl)-1...)
Show SMILES Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2C3(C)CCC(C3)C2(C)C)cc1
Show InChI InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)
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437n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082774
PNG
(CHEMBL3422787)
Show SMILES CCCCn1c2ccccc2cc(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C21H28N2O2/c1-3-4-13-23-19-8-6-5-7-16(19)14-18(21(23)25)20(24)22-17-11-9-15(2)10-12-17/h5-8,14-15,17H,3-4,9-13H2,1-2H3,(H,22,24)
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551n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062504
PNG
(CHEMBL3397518)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@H]1CC[C@H](C)CC1)-c1ccc(F)cc1
Show InChI InChI=1/C22H26FNO2/c1-14-4-10-19(11-5-14)24-22(25)20-13-17(12-15(2)21(20)26-3)16-6-8-18(23)9-7-16/h6-9,12-14,19H,4-5,10-11H2,1-3H3,(H,24,25)/t14-,19-
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620n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082772
PNG
(CHEMBL3422791)
Show SMILES CC1CCC(CC1)NC(=O)c1c(O)c2cccnc2n(CCN2CCOCC2)c1=O
Show InChI InChI=1S/C22H30N4O4/c1-15-4-6-16(7-5-15)24-21(28)18-19(27)17-3-2-8-23-20(17)26(22(18)29)10-9-25-11-13-30-14-12-25/h2-3,8,15-16,27H,4-7,9-14H2,1H3,(H,24,28)
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630n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50180036
PNG
((6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetra...)
Show SMILES CCCC(C)(C)c1ccc2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h8-10,14,18-19H,7,11-13H2,1-6H3/t18-,19+/m0/s1
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677n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50180036
PNG
((6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetra...)
Show SMILES CCCC(C)(C)c1ccc2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h8-10,14,18-19H,7,11-13H2,1-6H3/t18-,19+/m0/s1
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677n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cell membranes by [35S]GTPgammaS binding assay


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082771
PNG
(CHEMBL3422792)
Show SMILES CCCCn1c2ncccc2c(O)c(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C20H27N3O3/c1-3-4-12-23-18-15(6-5-11-21-18)17(24)16(20(23)26)19(25)22-14-9-7-13(2)8-10-14/h5-6,11,13-14,24H,3-4,7-10,12H2,1-2H3,(H,22,25)
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702n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082776
PNG
(CHEMBL3422785)
Show SMILES CC1CCC(CC1)NC(=O)c1cc2ccccc2n(CCN2CCOCC2)c1=O
Show InChI InChI=1S/C23H31N3O3/c1-17-6-8-19(9-7-17)24-22(27)20-16-18-4-2-3-5-21(18)26(23(20)28)11-10-25-12-14-29-15-13-25/h2-5,16-17,19H,6-15H2,1H3,(H,24,27)
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800n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062498
PNG
(CHEMBL3397448)
Show SMILES COc1c(C)cc(cc1C(=O)NC1CCCCCC1)-c1ccccc1
Show InChI InChI=1S/C22H27NO2/c1-16-14-18(17-10-6-5-7-11-17)15-20(21(16)25-2)22(24)23-19-12-8-3-4-9-13-19/h5-7,10-11,14-15,19H,3-4,8-9,12-13H2,1-2H3,(H,23,24)
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870n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062501
PNG
(CHEMBL3397450)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@@H]1CC[C@H](C)CC1)-c1ccccc1
Show InChI InChI=1/C22H27NO2/c1-15-9-11-19(12-10-15)23-22(24)20-14-18(13-16(2)21(20)25-3)17-7-5-4-6-8-17/h4-8,13-15,19H,9-12H2,1-3H3,(H,23,24)/t15-,19+
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1.09E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062506
PNG
(CHEMBL3397520)
Show SMILES CCCCc1cc(cc(C(=O)NC2CCCCCC2)c1OC)-c1ccc(OC)cc1
Show InChI InChI=1S/C26H35NO3/c1-4-5-10-20-17-21(19-13-15-23(29-2)16-14-19)18-24(25(20)30-3)26(28)27-22-11-8-6-7-9-12-22/h13-18,22H,4-12H2,1-3H3,(H,27,28)
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1.49E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062499
PNG
(CHEMBL3397449)
Show SMILES COc1c(C)cc(cc1C(=O)N[C@H]1CC[C@H](C)CC1)-c1ccccc1
Show InChI InChI=1/C22H27NO2/c1-15-9-11-19(12-10-15)23-22(24)20-14-18(13-16(2)21(20)25-3)17-7-5-4-6-8-17/h4-8,13-15,19H,9-12H2,1-3H3,(H,23,24)/t15-,19-
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1.53E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062508
PNG
(CHEMBL3397522)
Show SMILES CCCCc1cc(cc(C(=O)N[C@@H]2CC[C@H](C)CC2)c1OC)-c1ccc(OC)cc1
Show InChI InChI=1/C26H35NO3/c1-5-6-7-20-16-21(19-10-14-23(29-3)15-11-19)17-24(25(20)30-4)26(28)27-22-12-8-18(2)9-13-22/h10-11,14-18,22H,5-9,12-13H2,1-4H3,(H,27,28)/t18-,22+
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1.55E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062507
PNG
(CHEMBL3397521)
Show SMILES CCCCc1cc(cc(C(=O)N[C@H]2CC[C@H](C)CC2)c1OC)-c1ccc(OC)cc1
Show InChI InChI=1/C26H35NO3/c1-5-6-7-20-16-21(19-10-14-23(29-3)15-11-19)17-24(25(20)30-4)26(28)27-22-12-8-18(2)9-13-22/h10-11,14-18,22H,5-9,12-13H2,1-4H3,(H,27,28)/t18-,22-
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2.29E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082775
PNG
(CHEMBL3422786)
Show SMILES CCCn1c2ccccc2cc(C(=O)NC2CCC(C)CC2)c1=O
Show InChI InChI=1S/C20H26N2O2/c1-3-12-22-18-7-5-4-6-15(18)13-17(20(22)24)19(23)21-16-10-8-14(2)9-11-16/h4-7,13-14,16H,3,8-12H2,1-2H3,(H,21,23)
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2.61E+3n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082773
PNG
(CHEMBL3422789)
Show SMILES CC1CCC(CC1)NC(=O)c1cc2ccccc2n(CCCO)c1=O
Show InChI InChI=1S/C20H26N2O3/c1-14-7-9-16(10-8-14)21-19(24)17-13-15-5-2-3-6-18(15)22(20(17)25)11-4-12-23/h2-3,5-6,13-14,16,23H,4,7-12H2,1H3,(H,21,24)
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3.76E+3n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062496
PNG
(CHEMBL3397446)
Show SMILES COc1ccc(cc1)-c1cc(C)c(OC)c(c1)C(=O)N[C@H]1CC[C@H](C)CC1
Show InChI InChI=1/C23H29NO3/c1-15-5-9-19(10-6-15)24-23(25)21-14-18(13-16(2)22(21)27-4)17-7-11-20(26-3)12-8-17/h7-8,11-15,19H,5-6,9-10H2,1-4H3,(H,24,25)/t15-,19-
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062494
PNG
(CHEMBL3397445)
Show SMILES COc1ccc(cc1)-c1cc(C)c(OC)c(c1)C(=O)NC1CCCCCC1
Show InChI InChI=1S/C23H29NO3/c1-16-14-18(17-10-12-20(26-2)13-11-17)15-21(22(16)27-3)23(25)24-19-8-6-4-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,24,25)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50082770
PNG
(CHEMBL3422793)
Show SMILES CC1CCC(CC1)NC(=O)c1c(O)c2cccnc2n(CCCO)c1=O
Show InChI InChI=1S/C19H25N3O4/c1-12-5-7-13(8-6-12)21-18(25)15-16(24)14-4-2-9-20-17(14)22(19(15)26)10-3-11-23/h2,4,9,12-13,23-24H,3,5-8,10-11H2,1H3,(H,21,25)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from recombinant human CB1 receptor overexpressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 97: 10-8 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50062497
PNG
(CHEMBL3397447)
Show SMILES COc1ccc(cc1)-c1cc(C)c(OC)c(c1)C(=O)N[C@@H]1CC[C@H](C)CC1
Show InChI InChI=1/C23H29NO3/c1-15-5-9-19(10-6-15)24-23(25)21-14-18(13-16(2)22(21)27-4)17-7-11-20(26-3)12-8-17/h7-8,11-15,19H,5-6,9-10H2,1-4H3,(H,24,25)/t15-,19+
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062496
PNG
(CHEMBL3397446)
Show SMILES COc1ccc(cc1)-c1cc(C)c(OC)c(c1)C(=O)N[C@H]1CC[C@H](C)CC1
Show InChI InChI=1/C23H29NO3/c1-15-5-9-19(10-6-15)24-23(25)21-14-18(13-16(2)22(21)27-4)17-7-11-20(26-3)12-8-17/h7-8,11-15,19H,5-6,9-10H2,1-4H3,(H,24,25)/t15-,19-
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062494
PNG
(CHEMBL3397445)
Show SMILES COc1ccc(cc1)-c1cc(C)c(OC)c(c1)C(=O)NC1CCCCCC1
Show InChI InChI=1S/C23H29NO3/c1-16-14-18(17-10-12-20(26-2)13-11-17)15-21(22(16)27-3)23(25)24-19-8-6-4-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,24,25)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50062497
PNG
(CHEMBL3397447)
Show SMILES COc1ccc(cc1)-c1cc(C)c(OC)c(c1)C(=O)N[C@@H]1CC[C@H](C)CC1
Show InChI InChI=1/C23H29NO3/c1-15-5-9-19(10-6-15)24-23(25)21-14-18(13-16(2)22(21)27-4)17-7-11-20(26-3)12-8-17/h7-8,11-15,19H,5-6,9-10H2,1-4H3,(H,24,25)/t15-,19+
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 90: 526-36 (2015)

More data for this
Ligand-Target Pair
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