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SMILES: Brc1cc(C(=O)NC2CCCCCC2)c(=O)n(CCN2CCOCC2)c1

InChI Key: InChIKey=BGIRTFQKCXMFOC-UHFFFAOYSA-N

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 = 50495648   
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))
BDBM50495648
PNG
(CHEMBL3114179)
Show SMILES Brc1cc(C(=O)NC2CCCCCC2)c(=O)n(CCN2CCOCC2)c1
Show InChI InChI=1S/C19H28BrN3O3/c20-15-13-17(18(24)21-16-5-3-1-2-4-6-16)19(25)23(14-15)8-7-22-9-11-26-12-10-22/h13-14,16H,1-12H2,(H,21,24)
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
65n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 74: 524-32 (2014)


Article DOI: 10.1016/j.ejmech.2013.10.070
BindingDB Entry DOI: 10.7270/Q21V5HXR
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50495648
PNG
(CHEMBL3114179)
Show SMILES Brc1cc(C(=O)NC2CCCCCC2)c(=O)n(CCN2CCOCC2)c1
Show InChI InChI=1S/C19H28BrN3O3/c20-15-13-17(18(24)21-16-5-3-1-2-4-6-16)19(25)23(14-15)8-7-22-9-11-26-12-10-22/h13-14,16H,1-12H2,(H,21,24)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
243n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes after 90 mins


Eur J Med Chem 74: 524-32 (2014)


Article DOI: 10.1016/j.ejmech.2013.10.070
BindingDB Entry DOI: 10.7270/Q21V5HXR
More data for this
Ligand-Target Pair