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SMILES: Cc1cc(C)cc(CCNC(=O)Nc2ccc(Cl)cc2)c1

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50584048   
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


(Homo sapiens (Human))
BDBM50584048
PNG
(CHEMBL5081586)
Show SMILES Cc1cc(C)cc(CCNC(=O)Nc2ccc(Cl)cc2)c1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.61E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at N-terminal tagged human CB1 receptor transfected with HEK293 cells assessed as forskolin-stimulated cAMP level in presence of ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01432
BindingDB Entry DOI: 10.7270/Q2XP78TM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50584048
PNG
(CHEMBL5081586)
Show SMILES Cc1cc(C)cc(CCNC(=O)Nc2ccc(Cl)cc2)c1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.61E+3n/an/an/an/an/an/a


TBA

Assay Description
Allosteric antagonist activity against human CB1 receptor expressed in HEK293 cells membrane measured after 60 mins by [35S]GTPgammaS binding assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01432
BindingDB Entry DOI: 10.7270/Q2XP78TM
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50584048
PNG
(CHEMBL5081586)
Show SMILES Cc1cc(C)cc(CCNC(=O)Nc2ccc(Cl)cc2)c1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 29n/an/an/an/an/an/a


TBA

Assay Description
Allosteric antagonist activity at human CB1 receptor expressed in CHO-RD-HGA16 cells overexpressing Galpha16 assessed as inhibition of CP55940-stimul...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01432
BindingDB Entry DOI: 10.7270/Q2XP78TM
More data for this
Ligand-Target Pair