null

SMILES CN[C@@H](C)C(=O)N[C@H]1CCCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H](c1cn(CCCCc2ccc(CCCCn3cc(nn3)[C@@H](NC(=O)[C@@H]3CC[C@@H]4CCCC[C@H](NC(=O)[C@H](Cc5c[nH]c6ccccc56)NC(C)=O)C(=O)N34)c3ccccc3)cc2)nn1)c1ccccc1

InChI Key InChIKey=YZPQFHNIWBNBGH-AOOMQFHUSA-N

  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 10 hits for monomerid = 50343513   

TargetBaculoviral IAP repeat-containing protein 2(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataKi:  3nMAssay Description:Binding affinity to human cIAP1 BIR3 domain after 2 to 3 hrs by fluorescence polarization-based assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetBaculoviral IAP repeat-containing protein 2(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataKi:  6nMAssay Description:Binding affinity to human cIAP1 BIR2-BIR3 domain after 2 to 3 hrs by fluorescence polarization-based assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetBaculoviral IAP repeat-containing protein 3(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataKi:  11nMAssay Description:Binding affinity to human cIAP2 BIR3 domain after 2 to 3 hrs by fluorescence polarization-based assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataKi:  88nMAssay Description:Binding affinity to human XIAP linker BIR2-BIR3 domain expressed in Escherichia coli BL21(DE3) cells by fluorescence polarization-based assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataKi:  186nMAssay Description:Binding affinity to His-tagged human XIAP BIR3 domain expressed in Escherichia coli BL21(DE3) after 2 to 3 hrs by fluorescence polarization-based ass...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetBaculoviral IAP repeat-containing protein 3(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataIC50: 43nMAssay Description:Competitive inhibition of human cIAP2 BIR3 domain after 2 to 3 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetBaculoviral IAP repeat-containing protein 2(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataIC50: 23nMAssay Description:Competitive inhibition of human cIAP1BIR2-BIR3 domain after 2 to 3 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataIC50: 280nMAssay Description:Competitive inhibition of human XIAP linker BIR2-BIR3 domain expressed in Escherichia coli BL21(DE3) cells by fluorescence polarization-based assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataIC50: 618nMAssay Description:Competitive inhibition of His-tagged human XIAP BIR3 domain expressed in Escherichia coli BL21(DE3) after 2 to 3 hrs by fluorescence polarization ass...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed
TargetBaculoviral IAP repeat-containing protein 2(Homo sapiens (Human))
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50343513((3S,6S,10aS)-6-((S)-2-acetamido-3-(1H-indol-3-yl)p...)copy SMILEScopy InChI
Affinity DataIC50: 16nMAssay Description:Competitive inhibition of human cIAP1 BIR3 domain after 2 to 3 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2RJ4JSDPubMed