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BDBM50066798 CHEMBL3400538

SMILES: CCCC(=O)Nc1ccc(CCNC(=O)c2[nH]c3ccc(Cl)cc3c2CC)cc1

InChI Key: InChIKey=BPRKVZYPOIPJKM-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50066798   
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 1


(Homo sapiens (Human))
BDBM50066798
PNG
(CHEMBL3400538)
Show SMILES CCCC(=O)Nc1ccc(CCNC(=O)c2[nH]c3ccc(Cl)cc3c2CC)cc1
Show InChI InChI=1S/C23H26ClN3O2/c1-3-5-21(28)26-17-9-6-15(7-10-17)12-13-25-23(29)22-18(4-2)19-14-16(24)8-11-20(19)27-22/h6-11,14,27H,3-5,12-13H2,1-2H3,(H,25,29)(H,26,28)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human CB1 receptor expressed in CHO-RD-HGA16 cells assessed as inhibition of CP55940-induced calcium mobilization incubated fo...


Bioorg Med Chem 23: 2195-203 (2015)


Article DOI: 10.1016/j.bmc.2015.02.058
BindingDB Entry DOI: 10.7270/Q29888PG
More data for this
Ligand-Target Pair