quisinostat [Ligand Id: 7503] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL2105763 (JNJ 26481585, JNJ-26481585, Quisinostat)
  • histone deacetylase 1/Histone deacetylase 1 in Human [ChEMBL: CHEMBL325] [GtoPdb: 2658] [UniProtKB: Q13547]
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  • histone deacetylase 10/Histone deacetylase 10 in Human [ChEMBL: CHEMBL5103] [GtoPdb: 2614] [UniProtKB: Q969S8]
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  • histone deacetylase 11/Histone deacetylase 11 in Human [ChEMBL: CHEMBL3310] [GtoPdb: 2615] [UniProtKB: Q96DB2]
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  • histone deacetylase 2/Histone deacetylase 2 in Human [ChEMBL: CHEMBL1937] [GtoPdb: 2616] [UniProtKB: Q92769]
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  • histone deacetylase 3/Histone deacetylase 3 in Human [ChEMBL: CHEMBL1829] [GtoPdb: 2617] [UniProtKB: O15379]
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  • histone deacetylase 3/Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) in Human [ChEMBL: CHEMBL2111363] [GtoPdb: 2617] [UniProtKB: O15379Q9Y618]
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  • histone deacetylase 4/Histone deacetylase 4 in Human [ChEMBL: CHEMBL3524] [GtoPdb: 2659] [UniProtKB: P56524]
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  • histone deacetylase 5/Histone deacetylase 5 in Human [ChEMBL: CHEMBL2563] [GtoPdb: 2660] [UniProtKB: Q9UQL6]
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  • histone deacetylase 6/Histone deacetylase 6 in Human [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7]
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  • histone deacetylase 7/Histone deacetylase 7 in Human [ChEMBL: CHEMBL2716] [GtoPdb: 2661] [UniProtKB: Q8WUI4]
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  • Histone deacetylase 8 in Schistosoma mansoni [ChEMBL: CHEMBL3797017] [UniProtKB: A5H660]
  • histone deacetylase 8/Histone deacetylase 8 in Human [ChEMBL: CHEMBL3192] [GtoPdb: 2619] [UniProtKB: Q9BY41]
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  • histone deacetylase 9/Histone deacetylase 9 in Human [ChEMBL: CHEMBL4145] [GtoPdb: 2620] [UniProtKB: Q9UKV0]
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  • Leukotriene A4 hydrolase/Leukotriene A4 hydrolase in Human [ChEMBL: CHEMBL4618] [GtoPdb: 1395] [UniProtKB: P09960]
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  • sirtuin 1/NAD-dependent deacetylase sirtuin 1 in Human [ChEMBL: CHEMBL4506] [GtoPdb: 2707] [UniProtKB: Q96EB6]
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  • sirtuin 2/NAD-dependent deacetylase sirtuin 2 in Human [ChEMBL: CHEMBL4462] [GtoPdb: 2708] [UniProtKB: Q8IXJ6]
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  • sirtuin 3/NAD-dependent deacetylase sirtuin 3 in Human [ChEMBL: CHEMBL4461] [GtoPdb: 2709] [UniProtKB: Q9NTG7]
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  • sirtuin 7/NAD-dependent protein deacetylase sirtuin-7 in Human [ChEMBL: CHEMBL2163184] [GtoPdb: 2713] [UniProtKB: Q9NRC8]
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  • Plasmodium falciparum histone deacetylase 1 in Plasmodium falciparum 3D7 [GtoPdb: 3072] [UniProtKB: Q7K6A1]
  • Plasmodium falciparum histone deacetylase 1 in Plasmodium falciparum Dd2 [GtoPdb: 3072]
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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 using fluorogenic HDAC substrate after 15 mins by fluorimetrc method B 8.14 pKi 7.3 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human recombinant HDAC1 using Fluor de Lys as substrate after 2 hrs by fluorescence method B 9.32 pKi 0.48 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC1 B 10.52 pKi 0.03 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of HDAC1 (unknown origin) B 8.37 pIC50 4.26 nM IC50 Eur J Med Chem (2019) 164: 214-240 [PMID:30594678]
ChEMBL Inhibition of recombinant full length human HDAC1 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 9.21 pIC50 0.62 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
ChEMBL Inhibition of recombinant full length human HDAC1 expressed in baculovirus infected Sf9 cells using FAM-RHKK-Ac as substrate incubated for 17 hrs by electrophoretic mobility shift assay B 9.21 pIC50 0.62 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant human full length C-terminal His/FLAG tagged HDAC1 (1 to 482 residues) expressed in baculovirus-infected Sf9 cells using Ac-peptide as substrate incubated for 4 hrs B 9.34 pIC50 0.46 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
ChEMBL Inhibition of recombinant full length C-terminal FLAG His-tagged human HDAC1 expressed in baculovirus infected Sf21 insect cells using RHK-K(Ac)-AMC as substrate measured after 60 mins by fluorimetry analysis B 9.96 pIC50 0.11 nM IC50 J Med Chem (2021) 64: 3392-3426 [PMID:33661013]
GtoPdb - - 9.96 pIC50 0.11 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human HDAC1 expressed in baculovirus infected sf9 cells using p53 residues 379-382 (RHKKAc) as substrate by fluorescence-based assay B 10 pIC50 0.1 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
histone deacetylase 10/Histone deacetylase 10 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5103] [GtoPdb: 2614] [UniProtKB: Q969S8]
ChEMBL Inhibition of human recombinant HDAC10 using fluorogenic HDAC substrate after 45 mins by fluorimetrc method B 8.36 pKi 4.4 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC10 B 10.3 pKi 0.05 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of dye-labeled tracer binding to HDAC10 (unknown origin) transfected in human HeLa cells measured after 2 hrs by nano-luciferase reporter gene-based BRET assay B 7.4 pIC50 39.81 nM IC50 J Med Chem (2019) 62: 4426-4443 [PMID:30964290]
ChEMBL Inhibition of tubastatin-Alexa647-tracer binding to recombinant GST-tagged HDAC10 (unknown origin) measured after 1 hr by TR-FRET assay B 8 pIC50 10 nM IC50 J Med Chem (2019) 62: 4426-4443 [PMID:30964290]
ChEMBL Inhibition of recombinant full length human HDAC10 expressed in baculovirus infected Sf9 cells using FAM-RHKK-Ac as substrate incubated for 17 hrs by electrophoretic mobility shift assay B 8.71 pIC50 1.96 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant full length human HDAC10 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 8.71 pIC50 1.96 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
ChEMBL Inhibition of HDAC10 (unknown origin) B 9.3 pIC50 0.5 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
GtoPdb - - 9.34 pIC50 0.46 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
histone deacetylase 11/Histone deacetylase 11 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3310] [GtoPdb: 2615] [UniProtKB: Q96DB2]
ChEMBL Inhibition of human recombinant HDAC11 using fluorogenic HDAC substrate class 2a after 30 mins by fluorimetrc method B 5.89 pKi 1300 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC11 B 10.15 pKi 0.07 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of human HDAC11 expressed in baculovirus infected sf9 cells using (Boc-Lys(trifluoroacetyl)-AMC) as substrate by fluorescence-based assay B 9.4 pIC50 0.4 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
GtoPdb - - 9.43 pIC50 0.37 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
histone deacetylase 2/Histone deacetylase 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1937] [GtoPdb: 2616] [UniProtKB: Q92769]
ChEMBL Inhibition of human recombinant HDAC2 using fluorogenic HDAC substrate after 15 mins by fluorimetrc method B 7.51 pKi 31 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC2 B 10.22 pKi 0.06 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of HDAC2 (unknown origin) B 8.37 pIC50 4.26 nM IC50 Eur J Med Chem (2019) 164: 214-240 [PMID:30594678]
ChEMBL Inhibition of recombinant full length human HDAC2 expressed in baculovirus infected Sf9 cells using FAM-RHKK-Ac as substrate incubated for 17 hrs by electrophoretic mobility shift assay B 8.67 pIC50 2.16 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant full length human HDAC2 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 8.67 pIC50 2.16 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
ChEMBL Inhibition of recombinant human full length C-terminal His tagged HDAC2 (1 to 488 residues) expressed in baculovirus-infected Sf9 insect cells using Ac-peptide as substrate incubated for 4 hrs B 8.96 pIC50 1.1 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
GtoPdb - - 9.48 pIC50 0.33 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of recombinant full length C-terminal GST fusion-tagged human HDAC2 expressed in baculovirus infected insect cells using RHK-K(Ac)-AMC as substrate measured after 60 mins by fluorimetry analysis B 9.48 pIC50 0.33 nM IC50 J Med Chem (2021) 64: 3392-3426 [PMID:33661013]
ChEMBL Inhibition of human HDAC2 expressed in baculovirus infected sf9 cells using p53 residues 379-382 (RHKKAc) as substrate by fluorescence-based assay B 9.52 pIC50 0.3 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
histone deacetylase 3/Histone deacetylase 3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1829] [GtoPdb: 2617] [UniProtKB: O15379]
ChEMBL Inhibition of human recombinant HDAC3 using fluorogenic HDAC substrate after 10 mins by spectrophotometric method B 8.37 pKi 4.3 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC3 B 8.68 pKi 2.1 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
GtoPdb - - 8.31 pIC50 4.86 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human C-terminal His tagged HDAC3 (1 to 428 residues) expressed in baculovirus-infected Sf9 cells using Ac-peptide as substrate incubated for 4 hrs B 8.68 pIC50 2.1 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
histone deacetylase 3/Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2111363] [GtoPdb: 2617] [UniProtKB: O15379Q9Y618]
ChEMBL Inhibition of human HDAC3/NcoR2 expressed in sf9 cells using p53 residues 379-382 (RHKKAc) as substrate by fluorescence-based assay B 8.3 pIC50 5 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
GtoPdb - - 8.31 pIC50 4.86 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of C-terminal His-tagged recombinant human HDAC3 (1 to 428 residues)/N-terminal GST-tagged recombinant human NCoR2 (395 to 489 residues) co-expressed in baculovirus infected Sf9 cells using RHK-K(Ac)-AMCas substrate measured after 60 mins by fluorimetry analysis B 8.31 pIC50 4.86 nM IC50 J Med Chem (2021) 64: 3392-3426 [PMID:33661013]
histone deacetylase 4/Histone deacetylase 4 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3524] [GtoPdb: 2659] [UniProtKB: P56524]
ChEMBL Inhibition of human recombinant HDAC4 using fluorogenic HDAC substrate class 2a after 30 mins by fluorimetrc method B 8.17 pKi 6.7 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC4 B 9.52 pKi 0.3 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of recombinant full length human HDAC4 expressed in baculovirus infected Sf9 cells using FAM-RHKK-TFAc as substrate incubated for 1.5 hrs by electrophoretic mobility shift assay B 8.34 pIC50 4.61 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant full length human HDAC4 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 8.34 pIC50 4.61 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
GtoPdb - - 9.19 pIC50 0.64 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human HDAC4 expressed in baculovirus infected sf9 cells using (Boc-Lys(trifluoroacetyl)-AMC) as substrate by fluorescence-based assay B 9.22 pIC50 0.6 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
histone deacetylase 5/Histone deacetylase 5 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2563] [GtoPdb: 2660] [UniProtKB: Q9UQL6]
ChEMBL Inhibition of human recombinant HDAC5 using fluorogenic HDAC substrate class 2a after 30 mins by fluorimetrc method B 8.37 pKi 4.3 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC5 B 8.68 pKi 2.1 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of recombinant full length human HDAC5 expressed in baculovirus infected Sf9 cells using FAM-RHKK-TFAc as substrate incubated for 3 hrs by electrophoretic mobility shift assay B 8.23 pIC50 5.95 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant full length human HDAC5 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 8.23 pIC50 5.95 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
ChEMBL Inhibition of human HDAC5 expressed in baculovirus infected sf9 cells using (Boc-Lys(trifluoroacetyl)-AMC) as substrate by fluorescence-based assay B 8.4 pIC50 4 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
GtoPdb - - 8.43 pIC50 3.69 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
histone deacetylase 6/Histone deacetylase 6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7]
ChEMBL Inhibition of human recombinant HDAC6 using fluorogenic HDAC substrate after 30 mins by fluorimetrc method B 6.46 pKi 350 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC6 B 7.77 pKi 16.9 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
GtoPdb - - 7.11 pIC50 76.8 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human HDAC6 expressed in baculovirus infected sf9 cells using p53 residues 379-382 (RHKKAc) as substrate by fluorescence-based assay B 7.11 pIC50 77 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
ChEMBL Inhibition of full length recombinant human HDAC6 expressed in baculovirus infected Sf9 cells using RHKK-Ac as substrate by fluorescence analysis B 7.11 pIC50 76.8 nM IC50 J Med Chem (2016) 59: 8967-9004 [PMID:27606546]
ChEMBL Inhibition of recombinant full length N-terminal GST fusion-tagged human HDAC6 expressed in baculovirus infected Sf9 insect cells using RHK-K(Ac)-AMC as substrate measured after 90 mins by fluorimetry analysis B 7.11 pIC50 76.8 nM IC50 J Med Chem (2021) 64: 3392-3426 [PMID:33661013]
ChEMBL Inhibition of recombinant human full length N-terminal GST tagged HDAC6 (1 to 1215 residues) expressed in baculovirus-infected Sf9 cells using Ac-peptide as substrate incubated for 4 hrs B 7.46 pIC50 34.9 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
histone deacetylase 7/Histone deacetylase 7 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2716] [GtoPdb: 2661] [UniProtKB: Q8WUI4]
ChEMBL Inhibition of human HDAC7 B 7.18 pKi 66.6 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of human recombinant HDAC7 using fluorogenic HDAC substrate class 2a after 45 mins by fluorimetrc method B 8.77 pKi 1.7 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
GtoPdb - - 6.92 pIC50 119 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human HDAC7 expressed in baculovirus infected sf9 cells using (Boc-Lys(trifluoroacetyl)-AMC) as substrate by fluorescence-based assay B 6.92 pIC50 119 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
ChEMBL Inhibition of recombinant full length human HDAC7 expressed in baculovirus infected Sf9 cells using FAM-RHKK-TFAc as substrate incubated for 3 hrs by electrophoretic mobility shift assay B 8.39 pIC50 4.04 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant full length human HDAC7 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 8.39 pIC50 4.04 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
Histone deacetylase 8 in Schistosoma mansoni (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3797017] [UniProtKB: A5H660]
ChEMBL Binding affinity to Schistosoma mansoni His-tagged HDAC8 expressed in Escherichia coli BL21 (DE3) cells by ITC method B 7.55 pKd 28.4 nM Kd J Med Chem (2018) 61: 10000-10016 [PMID:30347148]
ChEMBL Inhibition of Schistosoma mansoni His-tagged HDAC8 expressed in Escherichia coli BL21 (DE3) cells using Fluor de Lys (R)-HDAC8 as substrate by fluorometric method B 6.52 pIC50 303.4 nM IC50 J Med Chem (2018) 61: 10000-10016 [PMID:30347148]
histone deacetylase 8/Histone deacetylase 8 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3192] [GtoPdb: 2619] [UniProtKB: Q9BY41]
ChEMBL Binding affinity to human His-thioredoxin-tagged HDAC8 expressed in Escherichia coli BL21 (DE3) cells by ITC method B 7.64 pKd 22.7 nM Kd J Med Chem (2018) 61: 10000-10016 [PMID:30347148]
ChEMBL Inhibition of human recombinant HDAC8 using fluorogenic HDAC substrate after 15 mins by fluorimetrc method B 7.62 pKi 24 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC8 B 9.3 pKi 0.5 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
ChEMBL Inhibition of human His-thioredoxin-tagged HDAC8 mL1/mL6/L179I mutant expressed in Escherichia coli BL21 (DE3) cells using Fluor de Lys (R)-HDAC8 as substrate by fluorometric method B 6.66 pIC50 217 nM IC50 J Med Chem (2018) 61: 10000-10016 [PMID:30347148]
ChEMBL Inhibition of human His-thioredoxin-tagged HDAC8 mL6/L179I mutant expressed in Escherichia coli BL21 (DE3) cells using Fluor de Lys (R)-HDAC8 as substrate by fluorometric method B 6.77 pIC50 169 nM IC50 J Med Chem (2018) 61: 10000-10016 [PMID:30347148]
ChEMBL Inhibition of human His-thioredoxin-tagged HDAC8 expressed in Escherichia coli BL21 (DE3) cells using Fluor de Lys (R)-HDAC8 as substrate by fluorometric method B 7.19 pIC50 64.4 nM IC50 J Med Chem (2018) 61: 10000-10016 [PMID:30347148]
ChEMBL Inhibition of recombinant human full length C-terminal His-tagged HDAC8 expressed in baculovirus-infected Sf9 insect cells using Ac-peptide as substrate incubated for 4 hrs followed by trypsin addition and further incubated for 2 hrs B 8.04 pIC50 9.2 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
GtoPdb - - 8.37 pIC50 4.26 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human HDAC8 expressed in baculovirus infected sf9 cells using p53 residues 379-382 (RHKAcKAc) as substrate by fluorescence-based assay B 8.4 pIC50 4 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
histone deacetylase 9/Histone deacetylase 9 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4145] [GtoPdb: 2620] [UniProtKB: Q9UKV0]
ChEMBL Inhibition of human recombinant HDAC9 using fluorogenic HDAC substrate class 2a after 30 mins by fluorimetrc method B 8.28 pKi 5.3 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human HDAC9 B 8.42 pKi 3.8 nM Ki Bioorg Med Chem (2015) 23: 5151-5155 [PMID:25637120]
GtoPdb - - 7.49 pIC50 32.1 nM IC50 Clin Cancer Res (2009) 15: 6841-51 [PMID:19861438]
ChEMBL Inhibition of human HDAC9 expressed in baculovirus infected sf9 cells using (Boc-Lys(trifluoroacetyl)-AMC) as substrate by fluorescence-based assay B 7.49 pIC50 32 nM IC50 J Med Chem (2020) 63: 12460-12484 [PMID:32608981]
ChEMBL Inhibition of recombinant human HDAC9 (604-1066 residues) expressed in baculovirus infected Sf9 cells using FAM-RHKK-TFAc as substrate incubated for 3 hrs by electrophoretic mobility shift assay B 8.17 pIC50 6.7 nM IC50 ACS Med Chem Lett (2020) 11: 56-64 [PMID:31938464]
ChEMBL Inhibition of recombinant full length human HDAC9 expressed in SF9 baculovirus using FAM- labelled acetylated peptide as substrate measured by Electrophoretic mobility shift assay B 8.17 pIC50 6.7 nM IC50 Eur J Med Chem (2020) 201: 112411-112411 [PMID:32615502]
Leukotriene A4 hydrolase/Leukotriene A4 hydrolase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4618] [GtoPdb: 1395] [UniProtKB: P09960]
ChEMBL Inhibition of recombinant human LTA4H Epoxide Hydrolase expressed in Escherichia coli BL21 (DE3) pLysS preincubated for 10 mins followed by addition of LTA4 as substrate measured after 15 mins by reverse-phase HPLC analysis B 5 pIC50 >10000 nM IC50 J Med Chem (2017) 60: 1817-1828 [PMID:28218840]
sirtuin 1/NAD-dependent deacetylase sirtuin 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4506] [GtoPdb: 2707] [UniProtKB: Q96EB6]
ChEMBL Inhibition of human recombinant SIRT1 using fluorogenic HDAC substrate after 20 mins by fluorimetrc method B 5 pKi >10000 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
sirtuin 2/NAD-dependent deacetylase sirtuin 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4462] [GtoPdb: 2708] [UniProtKB: Q8IXJ6]
ChEMBL Inhibition of human recombinant SIRT2 using fluoro-lysine sirtuin 2 deacetylase substrate after 60 mins by fluorimetrc method B 5 pKi >10000 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
ChEMBL Inhibition of human C-terminal His-tagged SIRT2 (50 to 356 residues) expressed in Escherichia coli using Ac-peptide as substrate incubated for 4 hrs followed by trypsin addition and further incubated for 2 hrs B 5 pIC50 >10000 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
sirtuin 3/NAD-dependent deacetylase sirtuin 3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4461] [GtoPdb: 2709] [UniProtKB: Q9NTG7]
ChEMBL Inhibition of human recombinant SIRT3 using fluoro-lysine sirtuin 2 deacetylase substrate after 45 mins by fluorimetrc method B 5 pKi >10000 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
sirtuin 7/NAD-dependent protein deacetylase sirtuin-7 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2163184] [GtoPdb: 2713] [UniProtKB: Q9NRC8]
ChEMBL Inhibition of SIRT7 (unknown origin) B 5 pKi >10000 nM Ki Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227]
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364]
ChEMBL Antimalarial activity against asexual blood stage chloroquine-resistant Plasmodium falciparum Dd2 assessed as parasite growth inhibition incubated for 72 hrs by SYBR Green I staining based fluorescence analysis F 8.15 pIC50 7.09 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
ChEMBL Antimalarial activity against asexual blood stage wild-type Plasmodium falciparum 3D7 assessed as parasite growth inhibition incubated for 72 hrs by SYBR Green I staining based fluorescence analysis F 8.4 pIC50 4.01 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
ChEMBL Antimalarial activity against asexual blood stage quinine-resistant Plasmodium falcipuram C2A assessed as parasite growth inhibition incubated for 72 hrs by SYBR Green I staining based fluorescence analysis F 8.6 pIC50 2.52 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
ChEMBL Antimalarial activity against asexual blood stage sulfadoxine-pyrimethamine/mefloquine-resistant Plasmodium falcipuram CP286 assessed as parasite growth inhibition incubated for 72 hrs by SYBR Green I staining based fluorescence analysis F 8.69 pIC50 2.04 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
ChEMBL Antimalarial activity against asexual blood stage chloroquine-resistant Plasmodium falcipuram GB4 assessed as parasite growth inhibition incubated for 72 hrs by SYBR Green I staining based fluorescence analysis F 8.76 pIC50 1.75 nM IC50 J Med Chem (2022) 65: 4156-4181 [PMID:35175762]
Plasmodium falciparum histone deacetylase 1 in Plasmodium falciparum 3D7 [GtoPdb: 3072] [UniProtKB: Q7K6A1]
GtoPdb Parasite growth inhibition assay - 8.28 pEC50 5.2 nM EC50 Cell Discov (2020) 6: 93 [PMID:33311461]
Plasmodium falciparum histone deacetylase 1 in Plasmodium falciparum Dd2 [GtoPdb: 3072]
GtoPdb Parasite growth inhibition assay - 8.15 pEC50 7.1 nM EC50 Cell Discov (2020) 6: 93 [PMID:33311461]

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]