BDBM50511993 CHEMBL4472879

SMILES O=C(N[C@H]1C[C@@H]1c1ccccc1)[C@@H]1CN(C[C@H]1C(=O)N[C@H]1C[C@@H]1c1ccccc1)C(=O)c1ccc(cc1)C(=O)N1C[C@H]([C@@H](C1)C(=O)N[C@H]1C[C@@H]1c1ccccc1)C(=O)N[C@H]1C[C@@H]1c1ccccc1

InChI Key InChIKey=ABZBNXFGYUSVCJ-UHFFFAOYSA-N

Data  8 EC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50511993   

TargetToll-like receptor 1(Human)
Southern Medical University

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  0.110nMAssay Description:Agonist activity at TLR1/2 in human THP-1 cells assessed as increase in TNF-alpha release incubated for 4 hrs by ELISAMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetToll-like receptor 2(Human)
University of Pittsburgh

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  0.110nMAssay Description:Agonist activity at TLR2 in human cells by cell based assayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetToll-like receptor 1(Human)
Southern Medical University

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  0.110nMAssay Description:Agonist activity at TLR1/TLR2 in human THP-1 derived macrophages assessed as stimulation of TNF alpha release measured for 4 hrs by ELISA based assayMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetToll-like receptor 2(Mouse)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  1.30nMAssay Description:Agonist activity at TLR1/TLR2 in wild type C57BL/6J mouse macrophages assessed as stimulation of TNF alpha release measured for 4 hrs by ELISA based ...More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetToll-like receptor 1(Human)
Southern Medical University

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  110nMAssay Description:Agonist activity at TLR1/TLR2 in human THP-1 cellsMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetToll-like receptor 2(Human)
University of Pittsburgh

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  15nMAssay Description:Agonist activity at human TLR2 expressed in HEK-Blue hTLR2 cells as SEAP expression incubated for 16 hrs by SEAP-based plate reader analysisMore data for this Ligand-Target Pair
In DepthDetails
PubMedPDB3D3D Structure (crystal)
TargetToll-like receptor 1(Human)
Southern Medical University

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  0.110nMAssay Description:Agonist activity at TLR2/TLR1 in human THP-1 cellsMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetToll-like receptor 1(Human)
Southern Medical University

Curated by ChEMBL
LigandPNGBDBM50511993(CHEMBL4472879)
Affinity DataEC50:  1.30nMAssay Description:Agonist activity at TLR2/TLR1 in mouse Macrophage cell lineMore data for this Ligand-Target Pair
In DepthDetails
PubMed