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BDBM50052613 3-(4,7-Dichloro-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-3-(3,4-dimethoxy-phenyl)-propionic acid methyl ester::CHEMBL111544

SMILES: COC(=O)CC(N1C(=O)c2c(C1=O)c(Cl)ccc2Cl)c1ccc(OC)c(OC)c1

InChI Key: InChIKey=OQKIQDAOUNDFRS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50052613   
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))		BDBM50052613
PNG
(3-(4,7-Dichloro-1,3-dioxo-1,3-dihydro-isoindol-2-y...)
Show SMILES COC(=O)CC(N1C(=O)c2c(C1=O)c(Cl)ccc2Cl)c1ccc(OC)c(OC)c1
Show InChI InChI=1S/C20H17Cl2NO6/c1-27-14-7-4-10(8-15(14)28-2)13(9-16(24)29-3)23-19(25)17-11(21)5-6-12(22)18(17)20(23)26/h4-8,13H,9H2,1-3H3
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MMDB

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Similars
Article
PubMed
n/an/a 7.90E+3n/an/an/an/an/an/a



Celgene Corporation

Curated by ChEMBL


Assay Description
Inhibitory activity of TNF-alpha was measured in the supernatant of human PBMCs stimulated with LPS.

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