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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 = 'BDBM50364079'   
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))
BDBM50364079
PNG
(CHEMBL1950934)
Show SMILES CC(=O)N1CCC(Cn2c(nc3cc(ccc23)S(=O)(=O)c2nccs2)C(C)(C)C)CC1
Show InChI InChI=1S/C22H28N4O3S2/c1-15(27)25-10-7-16(8-11-25)14-26-19-6-5-17(31(28,29)21-23-9-12-30-21)13-18(19)24-20(26)22(2,3)4/h5-6,9,12-13,16H,7-8,10-11,14H2,1-4H3
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 3.43E+3n/an/an/an/a



Janssen Research& Development

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor


Bioorg Med Chem Lett 22: 547-52 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.091
BindingDB Entry DOI: 10.7270/Q2JW8FBF
More data for this
Ligand-Target Pair