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SMILES: Nc1nc(cc(C2CCNCC2)c1C#C)-c1c(O)cccc1OCC1CC1

InChI Key: InChIKey=CXHKMZXKGRXLLW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50432990   
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
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))		BDBM50432990
PNG
(CHEMBL2375673)
Show SMILES Nc1nc(cc(C2CCNCC2)c1C#C)-c1c(O)cccc1OCC1CC1
Show InChI InChI=1S/C22H25N3O2/c1-2-16-17(15-8-10-24-11-9-15)12-18(25-22(16)23)21-19(26)4-3-5-20(21)27-13-14-6-7-14/h1,3-5,12,14-15,24,26H,6-11,13H2,(H2,23,25)
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Article
PubMed
n/an/a 8.5n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human IKKbeta using GST-IkappaBalpha as substrate

Eur J Med Chem 63: 269-78 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.045
BindingDB Entry DOI: 10.7270/Q2XG9SHG
More data for this
Ligand-Target Pair