BDBM27187 triazole-linked clarithromycin-based compound, 24c

SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)Cc2ccc(cc2)-c2cn(CCCCCCC(=O)NO)nn2)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)OC

InChI Key InChIKey=DRLFGGSHPHJCRP-NUOIGXOXSA-N

Data  4 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 4 hits for monomerid = 27187   

TargetHistone deacetylase 1(Homo sapiens (Human))
Georgia Institute of Technology

LigandPNGBDBM27187(triazole-linked clarithromycin-based compound, 24c)
Affinity DataIC50:  4.10nMpH: 8.0 T: 2°CAssay Description:The Fluor-de-Lys HDAC activity assay kit (Biomol) was used. Purified recombinant HDAC enzyme was incubated with Fluor-de-Lys substrate in the presenc...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 8(Homo sapiens (Human))
Adam Mickiewicz University

Curated by ChEMBL
LigandPNGBDBM27187(triazole-linked clarithromycin-based compound, 24c)
Affinity DataIC50:  1.89E+3nMAssay Description:Inhibition of HDAC8 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase (HDAC1 and HDAC2)(Homo sapiens (Human))
Adam Mickiewicz University

Curated by ChEMBL
LigandPNGBDBM27187(triazole-linked clarithromycin-based compound, 24c)
Affinity DataIC50:  4.10nMAssay Description:Inhibition of HDAC1/2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 8(Homo sapiens (Human))
Adam Mickiewicz University

Curated by ChEMBL
LigandPNGBDBM27187(triazole-linked clarithromycin-based compound, 24c)
Affinity DataIC50:  1.89E+3nMT: 2°CAssay Description:The Fluor-de-Lys HDAC activity assay kit (Biomol) was used. Purified recombinant HDAC enzyme was incubated with Fluor-de-Lys substrate in the presenc...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed