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SMILES: CNC(=O)CC(N1C(=O)c2ccccc2C1=O)c1ccc(OC)c(OC)c1

InChI Key: InChIKey=USPASZMTYOACPK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50052606   
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))		BDBM50052606
PNG
(3-(3,4-Dimethoxy-phenyl)-3-(1,3-dioxo-1,3-dihydro-...)
Show SMILES CNC(=O)CC(N1C(=O)c2ccccc2C1=O)c1ccc(OC)c(OC)c1
Show InChI InChI=1S/C20H20N2O5/c1-21-18(23)11-15(12-8-9-16(26-2)17(10-12)27-3)22-19(24)13-6-4-5-7-14(13)20(22)25/h4-10,15H,11H2,1-3H3,(H,21,23)
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MMDB

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Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Celgene Corporation

Curated by ChEMBL


Assay Description
Inhibition of TNF-alpha production in LPS stimulated human PBMCs

J Med Chem 39: 3238-40 (1996)


Article DOI: 10.1021/jm9603328
BindingDB Entry DOI: 10.7270/Q2V40T9Q
More data for this
Ligand-Target Pair