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SMILES: CS(=O)(=O)c1ccc(cc1)-c1ccc2ncc(n2n1)S(=O)(=O)N1CCN(CC1)c1ccccn1

InChI Key: InChIKey=ZHARYGLSAINZPL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50453992   
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
Tumor necrosis factor


(Homo sapiens (Human))		BDBM50453992
PNG
(CHEMBL4216524)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1ccc2ncc(n2n1)S(=O)(=O)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C22H22N6O4S2/c1-33(29,30)18-7-5-17(6-8-18)19-9-10-21-24-16-22(28(21)25-19)34(31,32)27-14-12-26(13-15-27)20-4-2-3-11-23-20/h2-11,16H,12-15H2,1H3
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n/an/a 1.20E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of LPS-induced TNF-alpha production in human PBMC preincubated for 30 mins followed by LPS addition measured after 5 hrs by ELISA

Bioorg Med Chem Lett 28: 24-30 (2018)


Article DOI: 10.1016/j.bmcl.2017.11.026
BindingDB Entry DOI: 10.7270/Q2TQ6441
More data for this
Ligand-Target Pair