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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50160437'   
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))
BDBM50160437
PNG
(1-((S)-1-{4-[4-Methoxy-2-(4-methoxy-benzenesulfony...)
Show SMILES CCCNC(=O)N[C@@H](C)c1ccc(cc1)S(=O)(=O)c1ccc(OC)cc1S(=O)(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C26H30N2O7S2/c1-5-16-27-26(29)28-18(2)19-6-11-22(12-7-19)36(30,31)24-15-10-21(35-4)17-25(24)37(32,33)23-13-8-20(34-3)9-14-23/h6-15,17-18H,5,16H2,1-4H3,(H2,27,28,29)/t18-/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
7.21E+4n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity for cannabinoid receptor 1


Bioorg Med Chem Lett 15: 783-6 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.007
BindingDB Entry DOI: 10.7270/Q2MW2GN7
More data for this
Ligand-Target Pair