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Found 1 hit Enz. Inhib. hit(s) with Target = 'Tumor necrosis factor' and Ligand = 'BDBM50453997'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Tumor necrosis factor


(Homo sapiens (Human))		BDBM50453997
PNG
(CHEMBL4204861)
Show SMILES O=S(=O)(NCC1CCCO1)c1cnc2ccc(nn12)-c1cccnc1
Show InChI InChI=1S/C16H17N5O3S/c22-25(23,19-10-13-4-2-8-24-13)16-11-18-15-6-5-14(20-21(15)16)12-3-1-7-17-9-12/h1,3,5-7,9,11,13,19H,2,4,8,10H2
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PC cid
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Article
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n/an/a 4.00E+3n/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