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BDBM50072355 CHEMBL3409151

SMILES: CCCCn1cc(C(=O)NC2CCCC2)c(=O)c2cccc(OC)c12

InChI Key: InChIKey=AODQAZVAXXWDGU-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50072355   
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))
BDBM50072355
PNG
(CHEMBL3409151)
Show SMILES CCCCn1cc(C(=O)NC2CCCC2)c(=O)c2cccc(OC)c12
Show InChI InChI=1S/C20H26N2O3/c1-3-4-12-22-13-16(20(24)21-14-8-5-6-9-14)19(23)15-10-7-11-17(25-2)18(15)22/h7,10-11,13-14H,3-6,8-9,12H2,1-2H3,(H,21,24)
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PC cid
PC sid
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Similars

Article
PubMed
20n/an/an/an/an/an/an/an/a



Institute of Pharmaceutical Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 receptor transfected in CHOK1 cells after 90 mins by liquid scintillation counting analysis


Eur J Med Chem 92: 554-64 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.028
BindingDB Entry DOI: 10.7270/Q2BP04H0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50072355
PNG
(CHEMBL3409151)
Show SMILES CCCCn1cc(C(=O)NC2CCCC2)c(=O)c2cccc(OC)c12
Show InChI InChI=1S/C20H26N2O3/c1-3-4-12-22-13-16(20(24)21-14-8-5-6-9-14)19(23)15-10-7-11-17(25-2)18(15)22/h7,10-11,13-14H,3-6,8-9,12H2,1-2H3,(H,21,24)
PDB

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Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Institute of Pharmaceutical Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 receptor transfected in CHOK1 cells after 90 mins by liquid scintillation counting analysis


Eur J Med Chem 92: 554-64 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.028
BindingDB Entry DOI: 10.7270/Q2BP04H0
More data for this
Ligand-Target Pair