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BDBM50124322 CHEMBL539837::N-{3-[3-Cyano-2-diethylamino-6-(2-hydroxy-phenyl)-pyridin-4-yl]-phenyl}-3-piperidin-1-yl-propionamide; hydrochloride

SMILES: CCN(CC)c1nc(cc(-c2cccc(NC(=O)CCN3CCCCC3)c2)c1C#N)-c1ccccc1O

InChI Key: InChIKey=HWZKQBMQYVBOQB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50124322   
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))		BDBM50124322
PNG
(CHEMBL539837 | N-{3-[3-Cyano-2-diethylamino-6-(2-h...)
Show SMILES CCN(CC)c1nc(cc(-c2cccc(NC(=O)CCN3CCCCC3)c2)c1C#N)-c1ccccc1O
Show InChI InChI=1S/C30H35N5O2/c1-3-35(4-2)30-26(21-31)25(20-27(33-30)24-13-6-7-14-28(24)36)22-11-10-12-23(19-22)32-29(37)15-18-34-16-8-5-9-17-34/h6-7,10-14,19-20,36H,3-5,8-9,15-18H2,1-2H3,(H,32,37)
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Similars
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Kyoto 619-0216

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration required against recombinant human IkB kinase beta (IKK-beta)

Bioorg Med Chem Lett 13: 913-8 (2003)


BindingDB Entry DOI: 10.7270/Q2TM7BP1
More data for this
Ligand-Target Pair