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BDBM50278518 1-(8-bromo-5-methoxy-2-methyl-2H-chromen-3-yl)ethanone::CHEMBL453459

SMILES: COc1ccc(Br)c2OC(C)C(=Cc12)C(C)=O

InChI Key: InChIKey=GKSOYHKQOWLPIY-UHFFFAOYSA-N

Data: 2 KI

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 = 50278518   
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


(Rattus norvegicus (rat))
BDBM50278518
PNG
(1-(8-bromo-5-methoxy-2-methyl-2H-chromen-3-yl)etha...)
Show SMILES COc1ccc(Br)c2OC(C)C(=Cc12)C(C)=O |c:11|
Show InChI InChI=1S/C13H13BrO3/c1-7(15)9-6-10-12(16-3)5-4-11(14)13(10)17-8(9)2/h4-6,8H,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from cannabinoid CB1 receptor in rat brain cortical membrane


Bioorg Med Chem 17: 2842-51 (2009)


Article DOI: 10.1016/j.bmc.2009.02.027
BindingDB Entry DOI: 10.7270/Q23R0TSC
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50278518
PNG
(1-(8-bromo-5-methoxy-2-methyl-2H-chromen-3-yl)etha...)
Show SMILES COc1ccc(Br)c2OC(C)C(=Cc12)C(C)=O |c:11|
Show InChI InChI=1S/C13H13BrO3/c1-7(15)9-6-10-12(16-3)5-4-11(14)13(10)17-8(9)2/h4-6,8H,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cells


Bioorg Med Chem 17: 2842-51 (2009)


Article DOI: 10.1016/j.bmc.2009.02.027
BindingDB Entry DOI: 10.7270/Q23R0TSC
More data for this
Ligand-Target Pair