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SMILES: NC(=O)c1cc(cc2c(c[nH]c12)C1CCN(CC1)S(=O)(=O)CCN1CCOCC1)-c1ccccc1

InChI Key: InChIKey=IBHBSLBQSHEYEW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50507362   
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))		BDBM50507362
PNG
(CHEMBL4473469)
Show SMILES NC(=O)c1cc(cc2c(c[nH]c12)C1CCN(CC1)S(=O)(=O)CCN1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C26H32N4O4S/c27-26(31)23-17-21(19-4-2-1-3-5-19)16-22-24(18-28-25(22)23)20-6-8-30(9-7-20)35(32,33)15-12-29-10-13-34-14-11-29/h1-5,16-18,20,28H,6-15H2,(H2,27,31)
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Article
PubMed
n/an/a 7.90n/an/an/an/an/an/a



GlaxoSmithKline Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human C-terminal GST-tagged IKKbeta (1 to 737 residues) expressed in baculovirus expression system using GST-IkBalpha subst...

ACS Med Chem Lett 9: 1164-1169 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00291
More data for this
Ligand-Target Pair