BDBM50195108 (S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamido)-N1-(2-(2-phenyl-1H-indol-3-yl)ethyl)octanediamide::CHEMBL216641

SMILES COc1ccc2[nH]c(C)c(CC(=O)N[C@@H](CCCCCC(=O)NO)C(=O)NCCc3c([nH]c4ccccc34)-c3ccccc3)c2c1

InChI Key InChIKey=VBWCMILVHANAGG-UHFFFAOYSA-N

Data  8 IC50

  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 = 50195108   

TargetHistone deacetylase 5(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibition of HDAC5 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 3(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 1.60nMAssay Description:Inhibition of HDAC3 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 0.800nMAssay Description:Inhibition of HDAC1 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 6(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 45nMAssay Description:Inhibition of HDAC6 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 7(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 4.20E+3nMAssay Description:Inhibition of HDAC7 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 8(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 200nMAssay Description:Inhibition of HDAC8 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 4nMAssay Description:Inhibition of HDAC2 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetHistone deacetylase 4(Human)
Irbm/Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50195108((S)-N8-hydroxy-2-(2-(5-methoxy-2-methyl-1H-indol-3...)
Affinity DataIC50: 260nMAssay Description:Inhibition of HDAC4 (mean IC50)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed