BDBM50309931 6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-tetraaza-tricyclo[11.11.2.0*3,7*]hexacos-10-yl)-hexanoic acid hydroxyamide::CHEMBL589311
SMILES: ONC(=O)CCCCC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H]2CCCCCCCCCCC[C@@H](NC1=O)C(=O)N2
InChI Key: InChIKey=TVNZWPOEHUTSFV-WZYRSQIMSA-N
Data: 6 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Histone deacetylase 1 (Homo sapiens (Human)) | BDBM50309931 (6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-te...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Graduate School of Life Science and Systems Engineering Curated by ChEMBL | Assay Description Inhibition of HDAC1 | Bioorg Med Chem Lett 20: 997-9 (2010) Article DOI: 10.1016/j.bmcl.2009.12.054 BindingDB Entry DOI: 10.7270/Q2BC3ZNR | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Histone deacetylase 4 (Homo sapiens (Human)) | BDBM50309931 (6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-te...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Graduate School of Life Science and Systems Engineering Curated by ChEMBL | Assay Description Inhibition of HDAC4 | Bioorg Med Chem Lett 20: 997-9 (2010) Article DOI: 10.1016/j.bmcl.2009.12.054 BindingDB Entry DOI: 10.7270/Q2BC3ZNR | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Histone deacetylase (Mus musculus) | BDBM50309931 (6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-te...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Indian CSIR-Central Drug Research Institute Curated by ChEMBL | Assay Description Inhibition of recombinant mouse HDAC6 expressed in HEK293T cells using Ac-KGLGK(Ac)-MCA as substrate measured after 30 mins by fluorescence assay | Eur J Med Chem 158: 620-706 (2018) Article DOI: 10.1016/j.ejmech.2018.08.073 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cereblon/Histone deacetylase 1 (Homo sapiens (Human)) | BDBM50309931 (6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-te...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Indian CSIR-Central Drug Research Institute Curated by ChEMBL | Assay Description Inhibition of recombinant human HDAC1 expressed in HEK293T cells using Ac-KGLGK(Ac)-MCA as substrate measured after 30 mins by fluorescence assay | Eur J Med Chem 158: 620-706 (2018) Article DOI: 10.1016/j.ejmech.2018.08.073 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cereblon/Histone deacetylase 4 (Homo sapiens (Human)) | BDBM50309931 (6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-te...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Indian CSIR-Central Drug Research Institute Curated by ChEMBL | Assay Description Inhibition of recombinant human HDAC4 expressed in HEK293T cells using Ac-KGLGK(Ac)-MCA as substrate measured after 30 mins by fluorescence assay | Eur J Med Chem 158: 620-706 (2018) Article DOI: 10.1016/j.ejmech.2018.08.073 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cereblon/Histone deacetylase 6 (Homo sapiens (Human)) | BDBM50309931 (6-((1S,7R,10S,13R)-2,8,11,26-Tetraoxo-3,9,12,25-te...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Graduate School of Life Science and Systems Engineering Curated by ChEMBL | Assay Description Inhibition of HDAC6 | Bioorg Med Chem Lett 20: 997-9 (2010) Article DOI: 10.1016/j.bmcl.2009.12.054 BindingDB Entry DOI: 10.7270/Q2BC3ZNR | |||||||||||
More data for this Ligand-Target Pair |