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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 = 'BDBM50543755'   
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))		BDBM50543755
PNG
(CHEMBL4638147)
Show SMILES CCCCCc1cc(OCCCCCCCCCCC(=O)NC2CC2)cc(OCC=C)c1
Show InChI InChI=1S/C28H45NO3/c1-3-5-12-15-24-21-26(31-19-4-2)23-27(22-24)32-20-14-11-9-7-6-8-10-13-16-28(30)29-25-17-18-25/h4,21-23,25H,2-3,5-20H2,1H3,(H,29,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
 14n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human recombinant CB1 receptor expressed in HEK cell membrane

Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115513
BindingDB Entry DOI: 10.7270/Q2R49VB2
More data for this
Ligand-Target Pair