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BDBM50257743 CHEMBL4080556

SMILES: O=C(NC12CC3CC(CC(C3)C1)C2)c1cc2ccccc2n1CCCCC#N

InChI Key: InChIKey=QJQHFZWDAXUMOY-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50257743   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))		BDBM50257743
PNG
(CHEMBL4080556)
Show SMILES O=C(NC12CC3CC(CC(C3)C1)C2)c1cc2ccccc2n1CCCCC#N |THB:8:7:4:10.9.11,8:9:6.7.12:4,11:9:6:12.3.4,11:3:6:10.8.9|
Show InChI InChI=1S/C24H29N3O/c25-8-4-1-5-9-27-21-7-3-2-6-20(21)13-22(27)23(28)26-24-14-17-10-18(15-24)12-19(11-17)16-24/h2-3,6-7,13,17-19H,1,4-5,9-12,14-16H2,(H,26,28)
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Article
PubMed
n/an/an/an/a 75n/an/an/an/a



Shanghai Engineering Research Center of Molecular Therapeutics and New Drug Development, School of Chemistry and Molecular Engineering, East China Normal University , 3663 North Zhongshan Road, Shang

Curated by ChEMBL


Assay Description
Antagonist activity at human CB2 receptor expressed in CHO cells assessed as inhibition of CP55940-induced Ca2+ flux preincubated for 10 mins followe...

J Med Chem 60: 7067-7083 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00724
BindingDB Entry DOI: 10.7270/Q20K2C17
More data for this
Ligand-Target Pair