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BDBM50072998 CHEMBL3410824

SMILES: CCCCCOc1c2C(=O)N(CCc3ccc(O)cc3)C(=O)c2ccc1OC

InChI Key: InChIKey=GDZPOSXPBHZEDX-UHFFFAOYSA-N

Data: 2 KI

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 = 50072998   
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))
BDBM50072998
PNG
(CHEMBL3410824)
Show SMILES CCCCCOc1c2C(=O)N(CCc3ccc(O)cc3)C(=O)c2ccc1OC
Show InChI InChI=1S/C22H25NO5/c1-3-4-5-14-28-20-18(27-2)11-10-17-19(20)22(26)23(21(17)25)13-12-15-6-8-16(24)9-7-15/h6-11,24H,3-5,12-14H2,1-2H3
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PC cid
PC sid
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Similars

Article
PubMed
7.30n/an/an/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor (unknown origin)


Eur J Med Chem 93: 16-32 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.054
BindingDB Entry DOI: 10.7270/Q28P626S
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50072998
PNG
(CHEMBL3410824)
Show SMILES CCCCCOc1c2C(=O)N(CCc3ccc(O)cc3)C(=O)c2ccc1OC
Show InChI InChI=1S/C22H25NO5/c1-3-4-5-14-28-20-18(27-2)11-10-17-19(20)22(26)23(21(17)25)13-12-15-6-8-16(24)9-7-15/h6-11,24H,3-5,12-14H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.30n/an/an/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor (unknown origin)


Eur J Med Chem 93: 16-32 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.054
BindingDB Entry DOI: 10.7270/Q28P626S
More data for this
Ligand-Target Pair