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BDBM50334012 4-(3-(1-isopropyl-4-(3-(trifluoromethyl)phenyl)-1H-imidazol-2-yl)benzyl)morpholine::CHEMBL1644668

SMILES: CC(C)n1cc(nc1-c1cccc(CN2CCOCC2)c1)-c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=IFSPIITUKXZDJT-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 = 50334012   
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))
BDBM50334012
PNG
(4-(3-(1-isopropyl-4-(3-(trifluoromethyl)phenyl)-1H...)
Show SMILES CC(C)n1cc(nc1-c1cccc(CN2CCOCC2)c1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C24H26F3N3O/c1-17(2)30-16-22(19-6-4-8-21(14-19)24(25,26)27)28-23(30)20-7-3-5-18(13-20)15-29-9-11-31-12-10-29/h3-8,13-14,16-17H,9-12,15H2,1-2H3
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 218n/an/an/an/a



Merck Research Laboratory

Curated by ChEMBL


Assay Description
Agonist activity at human cloned CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation


Bioorg Med Chem Lett 21: 182-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.044
BindingDB Entry DOI: 10.7270/Q20P108G
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50334012
PNG
(4-(3-(1-isopropyl-4-(3-(trifluoromethyl)phenyl)-1H...)
Show SMILES CC(C)n1cc(nc1-c1cccc(CN2CCOCC2)c1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C24H26F3N3O/c1-17(2)30-16-22(19-6-4-8-21(14-19)24(25,26)27)28-23(30)20-7-3-5-18(13-20)15-29-9-11-31-12-10-29/h3-8,13-14,16-17H,9-12,15H2,1-2H3
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
n/an/an/an/a>1.00E+3n/an/an/an/a



Merck Research Laboratory

Curated by ChEMBL


Assay Description
Agonist activity at human cloned CB1 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation


Bioorg Med Chem Lett 21: 182-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.044
BindingDB Entry DOI: 10.7270/Q20P108G
More data for this
Ligand-Target Pair