bavarostat [Ligand Id: 11119] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL4165724
  • histone deacetylase 1/Histone deacetylase 1 in Human [ChEMBL: CHEMBL325] [GtoPdb: 2658] [UniProtKB: Q13547]
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  • histone deacetylase 6/Histone deacetylase 6 in Human [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
histone deacetylase 1/Histone deacetylase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL325] [GtoPdb: 2658] [UniProtKB: Q13547]
ChEMBL Inhibition of human recombinant HDAC1 incubated for 90 mins using fluorogenic substrate ZMAL (Z-Lys(Ac)-AMC) by fluorescence based assay B 3 pIC50 >1000000 nM IC50 J Med Chem (2018) 61: 8054-8060 [PMID:30118224]
ChEMBL Inhibition of human recombinant HDAC1 using fluorogenic HDAC substrate by fluorescence assay B 6 pIC50 >1000 nM IC50 J Med Chem (2019) 62: 8557-8577 [PMID:31414801]
histone deacetylase 6/Histone deacetylase 6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7]
GtoPdb - - 7.22 pIC50 60 nM IC50 J Med Chem (2018) 61: 8054-8060 [PMID:30118224]
ChEMBL Inhibition of human recombinant HDAC6 incubated for 90 mins using fluorogenic substrate ZMAL (Z-Lys(Ac)-AMC) by fluorescence based assay B 7.22 pIC50 60 nM IC50 J Med Chem (2018) 61: 8054-8060 [PMID:30118224]
ChEMBL Inhibition of human recombinant HDAC6 using fluorogenic HDAC substrate by fluorescence assay B 7.22 pIC50 60 nM IC50 J Med Chem (2019) 62: 8557-8577 [PMID:31414801]

ChEMBL data shown on this page come from version 33:

Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]