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BDBM50267822 3,5-bis(trifluoromethyl)-N-(1-(2-(4-(trifluoromethyl)phenyl)acetyl)azetidin-3-yl)benzenesulfonamide::CHEMBL521596

SMILES: FC(F)(F)c1ccc(CC(=O)N2CC(C2)NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1

InChI Key: InChIKey=HIEVSAGIEPLFDB-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50267822   
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))
BDBM50267822
PNG
(3,5-bis(trifluoromethyl)-N-(1-(2-(4-(trifluorometh...)
Show SMILES FC(F)(F)c1ccc(CC(=O)N2CC(C2)NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1
Show InChI InChI=1S/C20H15F9N2O3S/c21-18(22,23)12-3-1-11(2-4-12)5-17(32)31-9-15(10-31)30-35(33,34)16-7-13(19(24,25)26)6-14(8-16)20(27,28)29/h1-4,6-8,15,30H,5,9-10H2
PDB

NCI pathway
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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human recombinant CB1R expressed in CHO cells


J Med Chem 52: 2550-8 (2009)


Article DOI: 10.1021/jm900063x
BindingDB Entry DOI: 10.7270/Q2028RF8
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50267822
PNG
(3,5-bis(trifluoromethyl)-N-(1-(2-(4-(trifluorometh...)
Show SMILES FC(F)(F)c1ccc(CC(=O)N2CC(C2)NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1
Show InChI InChI=1S/C20H15F9N2O3S/c21-18(22,23)12-3-1-11(2-4-12)5-17(32)31-9-15(10-31)30-35(33,34)16-7-13(19(24,25)26)6-14(8-16)20(27,28)29/h1-4,6-8,15,30H,5,9-10H2
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/an/an/a>1.00E+4n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inverse agonist activity at human recombinant CB1R expressed in CHO cells assessed as increase in forskolin-stimulated cAMP level


J Med Chem 52: 2550-8 (2009)


Article DOI: 10.1021/jm900063x
BindingDB Entry DOI: 10.7270/Q2028RF8
More data for this
Ligand-Target Pair