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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50323610   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50323610
PNG
(CHEMBL1209668 | N-(3-(3-bromophenyl)-4-(4-chloroph...)
Show SMILES CC(NC(=O)C(C)(C)Oc1ccc(cn1)C(F)(F)F)C(C)(Cc1ccc(Cl)cc1)c1cccc(Br)c1
Show InChI InChI=1S/C27H27BrClF3N2O2/c1-17(34-24(35)25(2,3)36-23-13-10-20(16-33-23)27(30,31)32)26(4,19-6-5-7-21(28)14-19)15-18-8-11-22(29)12-9-18/h5-14,16-17H,15H2,1-4H3,(H,34,35)
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Article
PubMed
n/an/a 25n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55490 from human recombinant cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 4757-61 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.127
BindingDB Entry DOI: 10.7270/Q2NK3F71
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50323610
PNG
(CHEMBL1209668 | N-(3-(3-bromophenyl)-4-(4-chloroph...)
Show SMILES CC(NC(=O)C(C)(C)Oc1ccc(cn1)C(F)(F)F)C(C)(Cc1ccc(Cl)cc1)c1cccc(Br)c1
Show InChI InChI=1S/C27H27BrClF3N2O2/c1-17(34-24(35)25(2,3)36-23-13-10-20(16-33-23)27(30,31)32)26(4,19-6-5-7-21(28)14-19)15-18-8-11-22(29)12-9-18/h5-14,16-17H,15H2,1-4H3,(H,34,35)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 260n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55490 from human recombinant cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 4757-61 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.127
BindingDB Entry DOI: 10.7270/Q2NK3F71
More data for this
Ligand-Target Pair