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7 similar compounds to monomer 50267713

Compile data set for download or QSAR
Wt: 333.4
BDBM50176949
Wt: 403.5
BDBM50176950
Wt: 433.6
BDBM50267714
Wt: 349.4
BDBM50267670
Wt: 405.5
BDBM50267671
Wt: 447.6
BDBM50267672
Wt: 419.5
BDBM50267673

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50176949,50176950,50267714,50267670,50267671,50267672,50267673   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50267671
PNG
(11-(3-butoxy-5-hydroxyphenoxy)-N-cyclopropylundeca...)
Show SMILES CCCCOc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C24H39NO4/c1-2-3-15-28-22-17-21(26)18-23(19-22)29-16-11-9-7-5-4-6-8-10-12-24(27)25-20-13-14-20/h17-20,26H,2-16H2,1H3,(H,25,27)
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120n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB2 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50267673
PNG
(CHEMBL521944 | N-cyclopropyl-11-(3-hydroxy-5-(isop...)
Show SMILES CC(C)CCOc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C25H41NO4/c1-20(2)14-16-30-24-18-22(27)17-23(19-24)29-15-10-8-6-4-3-5-7-9-11-25(28)26-21-12-13-21/h17-21,27H,3-16H2,1-2H3,(H,26,28)
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130n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB2 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50267714
PNG
(CHEMBL491065 | N-(cyclopropylmethyl)-11-(3-hydroxy...)
Show SMILES CC(C)CCOc1cc(O)cc(OCCCCCCCCCCC(=O)NCC2CC2)c1
Show InChI InChI=1S/C26H43NO4/c1-21(2)14-16-31-25-18-23(28)17-24(19-25)30-15-10-8-6-4-3-5-7-9-11-26(29)27-20-22-12-13-22/h17-19,21-22,28H,3-16,20H2,1-2H3,(H,27,29)
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200n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB2 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50267673
PNG
(CHEMBL521944 | N-cyclopropyl-11-(3-hydroxy-5-(isop...)
Show SMILES CC(C)CCOc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C25H41NO4/c1-20(2)14-16-30-24-18-22(27)17-23(19-24)29-15-10-8-6-4-3-5-7-9-11-25(28)26-21-12-13-21/h17-21,27H,3-16H2,1-2H3,(H,26,28)
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200n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB1 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50267672
PNG
(CHEMBL490246 | N-cyclopropyl-11-(3-(heptyloxy)-5-h...)
Show SMILES CCCCCCCOc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C27H45NO4/c1-2-3-4-10-13-18-31-25-20-24(29)21-26(22-25)32-19-14-11-8-6-5-7-9-12-15-27(30)28-23-16-17-23/h20-23,29H,2-19H2,1H3,(H,28,30)
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210n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB2 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50267671
PNG
(11-(3-butoxy-5-hydroxyphenoxy)-N-cyclopropylundeca...)
Show SMILES CCCCOc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C24H39NO4/c1-2-3-15-28-22-17-21(26)18-23(19-22)29-16-11-9-7-5-4-6-8-10-12-24(27)25-20-13-14-20/h17-20,26H,2-16H2,1H3,(H,25,27)
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251n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB1 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50267672
PNG
(CHEMBL490246 | N-cyclopropyl-11-(3-(heptyloxy)-5-h...)
Show SMILES CCCCCCCOc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C27H45NO4/c1-2-3-4-10-13-18-31-25-20-24(29)21-26(22-25)32-19-14-11-8-6-5-7-9-12-15-27(30)28-23-16-17-23/h20-23,29H,2-19H2,1H3,(H,28,30)
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2.00E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB1 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50267714
PNG
(CHEMBL491065 | N-(cyclopropylmethyl)-11-(3-hydroxy...)
Show SMILES CC(C)CCOc1cc(O)cc(OCCCCCCCCCCC(=O)NCC2CC2)c1
Show InChI InChI=1S/C26H43NO4/c1-21(2)14-16-31-25-18-23(28)17-24(19-25)30-15-10-8-6-4-3-5-7-9-11-26(29)27-20-22-12-13-22/h17-19,21-22,28H,3-16,20H2,1-2H3,(H,27,29)
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2.30E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CB1 receptor expressed in african green monkey COS cells by radioligand binding assay


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50176950
PNG
(16-(3-hydroxyphenoxy)hexadecanoic acid cyclopropyl...)
Show SMILES Oc1cccc(OCCCCCCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C25H41NO3/c27-23-15-14-16-24(21-23)29-20-13-11-9-7-5-3-1-2-4-6-8-10-12-17-25(28)26-22-18-19-22/h14-16,21-22,27H,1-13,17-20H2,(H,26,28)
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4.25E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB1 receptor expressed in COS cells


J Med Chem 48: 7343-50 (2005)


Article DOI: 10.1021/jm0501533
BindingDB Entry DOI: 10.7270/Q2FX7B7W
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50176949
PNG
(11-(3-hydroxyphenoxy)undecanoic acid cyclopropilam...)
Show SMILES Oc1cccc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C20H31NO3/c22-18-10-9-11-19(16-18)24-15-8-6-4-2-1-3-5-7-12-20(23)21-17-13-14-17/h9-11,16-17,22H,1-8,12-15H2,(H,21,23)
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5.40E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB2 receptor expressed in COS cells


J Med Chem 48: 7343-50 (2005)


Article DOI: 10.1021/jm0501533
BindingDB Entry DOI: 10.7270/Q2FX7B7W
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50176949
PNG
(11-(3-hydroxyphenoxy)undecanoic acid cyclopropilam...)
Show SMILES Oc1cccc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C20H31NO3/c22-18-10-9-11-19(16-18)24-15-8-6-4-2-1-3-5-7-12-20(23)21-17-13-14-17/h9-11,16-17,22H,1-8,12-15H2,(H,21,23)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB1 receptor expressed in COS cells


J Med Chem 48: 7343-50 (2005)


Article DOI: 10.1021/jm0501533
BindingDB Entry DOI: 10.7270/Q2FX7B7W
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50267670
PNG
(CHEMBL490046 | N-cyclopropyl-11-(3,5-dihydroxyphen...)
Show SMILES Oc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C20H31NO4/c22-17-13-18(23)15-19(14-17)25-12-8-6-4-2-1-3-5-7-9-20(24)21-16-10-11-16/h13-16,22-23H,1-12H2,(H,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor in rat brain membrane


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50267670
PNG
(CHEMBL490046 | N-cyclopropyl-11-(3,5-dihydroxyphen...)
Show SMILES Oc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C20H31NO4/c22-17-13-18(23)15-19(14-17)25-12-8-6-4-2-1-3-5-7-9-20(24)21-16-10-11-16/h13-16,22-23H,1-12H2,(H,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to CB1 receptor in rat spleen membrane


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50267670
PNG
(CHEMBL490046 | N-cyclopropyl-11-(3,5-dihydroxyphen...)
Show SMILES Oc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C20H31NO4/c22-17-13-18(23)15-19(14-17)25-12-8-6-4-2-1-3-5-7-9-20(24)21-16-10-11-16/h13-16,22-23H,1-12H2,(H,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to CB1 receptor in rat brain membrane


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50267670
PNG
(CHEMBL490046 | N-cyclopropyl-11-(3,5-dihydroxyphen...)
Show SMILES Oc1cc(O)cc(OCCCCCCCCCCC(=O)NC2CC2)c1
Show InChI InChI=1S/C20H31NO4/c22-17-13-18(23)15-19(14-17)25-12-8-6-4-2-1-3-5-7-9-20(24)21-16-10-11-16/h13-16,22-23H,1-12H2,(H,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor in rat spleen membrane


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair