BDBM50501804 CHEMBL4517719

SMILES Clc1cccc(Cl)c1C(=O)Nc1ccc2[nH]nc(-c3ccc4[nH]ccc4c3)c2c1

InChI Key InChIKey=AZPDJGLJPDRCDQ-UHFFFAOYSA-N

Data  2 IC50  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50501804   

TargetLymphocyte antigen 96(Mus musculus)
Wenzhou Medical University

Curated by ChEMBL
LigandPNGBDBM50501804(CHEMBL4517719)
Affinity DataIC50:  890nMAssay Description:Inhibition of MD2-TLR4 protein-protein interaction in ICR mouse peritoneal macrophages assessed as reduction in LPS-induced TNFalpha production prein...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetToll-like receptor 4(Homo sapiens (Human))
Wenzhou Medical University

Curated by ChEMBL
LigandPNGBDBM50501804(CHEMBL4517719)
Affinity DataKd:  1.46E+5nMAssay Description:Binding affinity to recombinant human C-terminal 10His-tagged TLR4 (Glu24 to Lys631 residues) expressed in mouse NS0 cells by surface plasmon resonan...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLymphocyte antigen 96(Homo sapiens (Human))
Wenzhou Medical University

Curated by ChEMBL
LigandPNGBDBM50501804(CHEMBL4517719)
Affinity DataKd:  1.85E+5nMAssay Description:Binding affinity to recombinant human 10His-tagged MD2 (Glu17 to Asn160 residues) expressed in Escherichia coli by surface plasmon resonance analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLymphocyte antigen 96(Mus musculus)
Wenzhou Medical University

Curated by ChEMBL
LigandPNGBDBM50501804(CHEMBL4517719)
Affinity DataIC50:  530nMAssay Description:Inhibition of MD2-TLR4 protein-protein interaction in ICR mouse peritoneal macrophages assessed as reduction in LPS-induced IL-6 production preincuba...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed