BDBM50302077 (3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobutyl-9-methyl-6-(6-oxooctyl)-1,4,7,10-tetraazacyclotridecane-2,5,8,11-tetraone::CHEMBL583130

SMILES CCC(=O)CCCCC[C@@H]1NC(=O)[C@H](C)NC(=O)C[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O

InChI Key InChIKey=RIIWGLKYAIUMGL-LQMNMMRTSA-N

Data  8 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50302077   

LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50:  140nMAssay Description:Inhibition of HDAC3-NCoR2 in human HeLa cells nuclear extract using Fluor-de-Lys as substrate after 30 mins by spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 1(Homo sapiens (Human))
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50:  26nMAssay Description:Inhibition of human recombinant HDAC1 after 30 mins by fluorimetric assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 3(Homo sapiens (Human))
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50:  143nMAssay Description:Inhibition of human recombinant HDAC3 after 30 mins by fluorimetric assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 6(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of HDAC6 in human HeLa cells nuclear extract using Fluor-de-Lys as substrate after 30 mins by spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 6(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of human recombinant HDAC6 after 30 mins by fluorimetric assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 8(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50:  2.20E+3nMAssay Description:Inhibition of HDAC8 in human HeLa cells nuclear extract using Arg-His-Lys(Ac)-Lys(Ac)-AMC as substrate after 30 mins by spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 1(Homo sapiens (Human))
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50:  26nMAssay Description:Inhibition of HDAC1 in human HeLa cells nuclear extract using Fluor-de-Lys as substrate after 30 mins by spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 8(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50302077((3S,6S,9S,13S)-3-((1H-indol-3-yl)methyl)-13-isobut...)
Affinity DataIC50:  2.20E+3nMAssay Description:Inhibition of human recombinant HDAC8 after 30 mins by fluorimetric assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed