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BDBM50154581 CHEMBL3775328

SMILES: CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)-c1ccccc1

InChI Key: InChIKey=RIIBZAQEPLXYLW-UHFFFAOYSA-N

Data: 2 KI  1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50154581   
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))
BDBM50154581
PNG
(CHEMBL3775328)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)-c1ccccc1
Show InChI InChI=1S/C24H31N5O2/c1-2-3-11-16-28-17-20(22(30)25-19-14-9-4-5-10-15-19)23(31)29-24(28)26-21(27-29)18-12-7-6-8-13-18/h6-8,12-13,17,19H,2-5,9-11,14-16H2,1H3,(H,25,30)
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PubMed
48n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in CHO cell membranes after 60 mins by scintillation counting analysis


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50154581
PNG
(CHEMBL3775328)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)-c1ccccc1
Show InChI InChI=1S/C24H31N5O2/c1-2-3-11-16-28-17-20(22(30)25-19-14-9-4-5-10-15-19)23(31)29-24(28)26-21(27-29)18-12-7-6-8-13-18/h6-8,12-13,17,19H,2-5,9-11,14-16H2,1H3,(H,25,30)
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2.48E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB1 receptor expressed in CHO cell membranes after 90 mins by scintillation counting analysis


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50154581
PNG
(CHEMBL3775328)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)-c1ccccc1
Show InChI InChI=1S/C24H31N5O2/c1-2-3-11-16-28-17-20(22(30)25-19-14-9-4-5-10-15-19)23(31)29-24(28)26-21(27-29)18-12-7-6-8-13-18/h6-8,12-13,17,19H,2-5,9-11,14-16H2,1H3,(H,25,30)
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n/an/an/an/a 849n/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inverse agonist activity at human CB2 receptor transfected in CHO cells assessed as increase in forksolin stimulated cAMP production by scintillation...


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50154581
PNG
(CHEMBL3775328)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)-c1ccccc1
Show InChI InChI=1S/C24H31N5O2/c1-2-3-11-16-28-17-20(22(30)25-19-14-9-4-5-10-15-19)23(31)29-24(28)26-21(27-29)18-12-7-6-8-13-18/h6-8,12-13,17,19H,2-5,9-11,14-16H2,1H3,(H,25,30)
PDB

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PubMed
n/an/a 142n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity at human CB2 receptor transfected in CHO cells assessed as inhibition of WIN 55,212-2 mediated suppression of forksolin induced c...


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair