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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 = 'BDBM50494094'   
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


(Rattus norvegicus (rat))
BDBM50494094
PNG
(CHEMBL2441445)
Show SMILES CCCCCn1c2ccccc2c2cc(ccc12)C(=S)N1CCCCC1
Show InChI InChI=1S/C23H28N2S/c1-2-3-7-16-25-21-11-6-5-10-19(21)20-17-18(12-13-22(20)25)23(26)24-14-8-4-9-15-24/h5-6,10-13,17H,2-4,7-9,14-16H2,1H3
PDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
41n/an/an/an/an/an/an/an/a



The University of Montana

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CB1 receptor in rat brain homogenate after 1.5 hrs by microbeta liquid scintillation counting analysis


Eur J Med Chem 69: 881-907 (2013)


Article DOI: 10.1016/j.ejmech.2013.09.038
BindingDB Entry DOI: 10.7270/Q20P12Z8
More data for this
Ligand-Target Pair