BDBM50239499 CHEMBL4081711::US10329302, Example 344::US10793579, Example 374::US11702424, Example 374

SMILES CC[C@H]1[C@@H](COc2nccc3cc(C(N)=O)c(OC)cc23)NC(=O)[C@H]1F

InChI Key InChIKey=JKDGKIBAOAFRPJ-ZBINZKHDSA-N

Data  19 IC50

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 50239499   

TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  2nMAssay Description:Inhibition of IRAK4 in human PBMC assessed as reduction in R848-stimulated TNF alpha production after 3 hrsMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  2.40nMAssay Description:Inhibition of IRAK4 in human PBMC cells assessed as reduction in R848-stimulated TNF-alpha productionMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

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In DepthDetails ArticlePubMedPDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:Inhibition of N-terminal His6-tagged human full length IRAK4 preincubated for 20 mins followed by biotinylated-AGAGRDKYKTLRQIR substrate addition in ...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

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In DepthDetails ArticlePubMedPDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  2nMAssay Description:Inhibition of IRAK4 in human whole blood assessed as reduction R848-induced IL-6 secretion by measuring plasma protein binding corrected IC50 preincu...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

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In DepthDetails ArticlePubMedPDB3D Structure (crystal)
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TargetVascular endothelial growth factor receptor 2(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  5.33E+3nMAssay Description:Inhibition of human recombinant VEGFR2 using CAGAGAIETDKEYYTVKD as substrate after 60 mins by Lance methodMore data for this Ligand-Target Pair

Target InfoPDBMMDBNCI pathwayReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

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In DepthDetails ArticlePubMed
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.100nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:Protocol B: To begin the assay, 45 μL of reaction mixture containing 20 mM HEPES pH=7.5, 5 mM MgCl2, 0.0025% Brij-35, 600 μM ATP, 228 μ...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:Protocol B: To begin the assay, 45 μL of reaction mixture containing 20 mM HEPES pH=7.5, 5 mM MgCl2, 0.0025% Brij-35, 600 μM ATP, 228 μ...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:Protocol B: To begin the assay, 45 μL of reaction mixture containing 20 mM HEPES pH=7.5, 5 mM MgCl2, 0.0025% Brij-35, 600 μM ATP, 228 μ...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
Copy reaction URL

TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.100nMAssay Description:Protocol B: To begin the assay, 45 μL of reaction mixture containing 20 mM HEPES pH=7.5, 5 mM MgCl2, 0.0025% Brij-35, 600 μM ATP, 228 μ...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
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TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
Copy reaction URL

TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.100nMAssay Description:This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails US Patent
PDB3D Structure (crystal)
Copy BDB DOI
Copy reaction URL

TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  0.200nMAssay Description:Inhibition of full-length IRAK4 (unknown origin) in presence of ATP by DELFIA assayMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMedPDB3D Structure (crystal)
Copy BDB DOI
Copy reaction URL

TargetInterleukin-1 receptor-associated kinase 4(Human)
Pfizer

Curated by ChEMBL

LigandBDBM50239499(CHEMBL4081711 | US10329302, Example 344 | US107935...)Copy SMILESCopy InChI

Affinity DataIC50:  2nMAssay Description:Inhibition of IRAK4 in human PBMC assessed as reduction in R848-stimulated TNF alpha production by measuring plasma protein binding corrected IC50 af...More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMedPDB3D Structure (crystal)
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Copy reaction URL