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BDBM50272314 CHEMBL500134::N-(2-Chloro-4-(trifluoromethyl)phenyl)-3-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl)propanamide

SMILES: Fc1ccc(-c2noc(CCC(=O)Nc3ccc(cc3Cl)C(F)(F)F)n2)c(Cl)c1

InChI Key: InChIKey=WXRLDKFKDMBCCE-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50272314   
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))
BDBM50272314
PNG
(CHEMBL500134 | N-(2-Chloro-4-(trifluoromethyl)phen...)
Show SMILES Fc1ccc(-c2noc(CCC(=O)Nc3ccc(cc3Cl)C(F)(F)F)n2)c(Cl)c1
Show InChI InChI=1S/C18H11Cl2F4N3O2/c19-12-8-10(21)2-3-11(12)17-26-16(29-27-17)6-5-15(28)25-14-4-1-9(7-13(14)20)18(22,23)24/h1-4,7-8H,5-6H2,(H,25,28)
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 370n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in Sf9 cells by GTP-europium binding assay


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50272314
PNG
(CHEMBL500134 | N-(2-Chloro-4-(trifluoromethyl)phen...)
Show SMILES Fc1ccc(-c2noc(CCC(=O)Nc3ccc(cc3Cl)C(F)(F)F)n2)c(Cl)c1
Show InChI InChI=1S/C18H11Cl2F4N3O2/c19-12-8-10(21)2-3-11(12)17-26-16(29-27-17)6-5-15(28)25-14-4-1-9(7-13(14)20)18(22,23)24/h1-4,7-8H,5-6H2,(H,25,28)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in Sf9 cells by GTP-europium binding assay


J Med Chem 51: 5019-34 (2008)


Article DOI: 10.1021/jm800463f
BindingDB Entry DOI: 10.7270/Q2W096VS
More data for this
Ligand-Target Pair