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PubMed code 15993070

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM21282
PNG
(2-methyl-3-(naphthalen-1-ylcarbonyl)-1-propyl-1H-i...)
Show SMILES CCCn1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc12
Show InChI InChI=1S/C23H21NO/c1-3-15-24-16(2)22(20-12-6-7-14-21(20)24)23(25)19-13-8-10-17-9-4-5-11-18(17)19/h4-14H,3,15H2,1-2H3
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Article
PubMed
36n/an/an/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
In vitro inhibitory activity towards human cannabinoid receptors 2 using fluorescence assay


Bioorg Med Chem Lett 15: 3758-62 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.049
BindingDB Entry DOI: 10.7270/Q2930SQC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50169750
PNG
((2-Methyl-1-propyl-1H-indol-3-yl)-(3-nitro-naphtha...)
Show SMILES CCCn1c(C)c(C(=O)c2cc(cc3ccccc23)[N+]([O-])=O)c2ccccc12
Show InChI InChI=1S/C23H20N2O3/c1-3-12-24-15(2)22(19-10-6-7-11-21(19)24)23(26)20-14-17(25(27)28)13-16-8-4-5-9-18(16)20/h4-11,13-14H,3,12H2,1-2H3
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PubMed
143n/an/an/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
In vitro inhibitory activity towards human cannabinoid receptors 2 using fluorescence assay


Bioorg Med Chem Lett 15: 3758-62 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.049
BindingDB Entry DOI: 10.7270/Q2930SQC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50169752
PNG
((3-Amino-naphthalen-1-yl)-(2-methyl-1-propyl-1H-in...)
Show SMILES CCCn1c(C)c(C(=O)c2cc(N)cc3ccccc23)c2ccccc12
Show InChI InChI=1S/C23H22N2O/c1-3-12-25-15(2)22(19-10-6-7-11-21(19)25)23(26)20-14-17(24)13-16-8-4-5-9-18(16)20/h4-11,13-14H,3,12,24H2,1-2H3
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PubMed
191n/an/an/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
In vitro inhibitory activity towards human cannabinoid receptors 2 using fluorescence assay


Bioorg Med Chem Lett 15: 3758-62 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.049
BindingDB Entry DOI: 10.7270/Q2930SQC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50169751
PNG
(CHEMBL555145 | [4-(2-Methyl-1-propyl-1H-indole-3-c...)
Show SMILES CCCn1c(C)c(C(=O)c2cc(NC(=O)C[NH3+])cc3ccccc23)c2ccccc12
Show InChI InChI=1S/C25H25N3O2/c1-3-12-28-16(2)24(20-10-6-7-11-22(20)28)25(30)21-14-18(27-23(29)15-26)13-17-8-4-5-9-19(17)21/h4-11,13-14H,3,12,15,26H2,1-2H3,(H,27,29)/p+1
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Article
PubMed
420n/an/an/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
In vitro inhibitory activity towards human cannabinoid receptors 2 using fluorescence assay


Bioorg Med Chem Lett 15: 3758-62 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.049
BindingDB Entry DOI: 10.7270/Q2930SQC
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%