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BDBM50401059 CHEMBL2206838

SMILES: CCCCCn1cc(C(=O)c2ccc(I)c3ccccc23)c2ccccc12

InChI Key: InChIKey=USKZVVYKFRBNFR-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 = 50401059   
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))
BDBM50401059
PNG
(CHEMBL2206838)
Show SMILES CCCCCn1cc(C(=O)c2ccc(I)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C24H22INO/c1-2-3-8-15-26-16-21(19-11-6-7-12-23(19)26)24(27)20-13-14-22(25)18-10-5-4-9-17(18)20/h4-7,9-14,16H,2-3,8,15H2,1H3
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PC cid
PC sid
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Similars

Article
PubMed
1.30n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells after 1 hr by liquid scintillation spectrophotometry


Bioorg Med Chem 20: 2067-81 (2012)


Article DOI: 10.1016/j.bmc.2012.01.038
BindingDB Entry DOI: 10.7270/Q2PG1SW6
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50401059
PNG
(CHEMBL2206838)
Show SMILES CCCCCn1cc(C(=O)c2ccc(I)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C24H22INO/c1-2-3-8-15-26-16-21(19-11-6-7-12-23(19)26)24(27)20-13-14-22(25)18-10-5-4-9-17(18)20/h4-7,9-14,16H,2-3,8,15H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.5n/an/an/an/an/an/an/an/a



RTI International

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in HEK293 cells after 1 hr by liquid scintillation spectrophotometry


Bioorg Med Chem 20: 2067-81 (2012)


Article DOI: 10.1016/j.bmc.2012.01.038
BindingDB Entry DOI: 10.7270/Q2PG1SW6
More data for this
Ligand-Target Pair