BDBM50579542 CHEMBL4878408

SMILES COc1ccc(cc1OC(C(C)C)C(=O)NO)N(C)c1nc(C)nc2ccccc12

InChI Key InChIKey=ZTYHIBVAHSWEEK-UHFFFAOYSA-N

Data  17 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50579542   

TargetHistone deacetylase 9(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of C-terminal GST-tagged full length human HDAC9 (604 to 1066 residues) expressed in baculovirus expression system using Ac-peptide-AMC as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2E1(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 6.92E+4nMAssay Description:Inhibition of CYP2E1 in human liver microsomes using probe substrate in presence of NADPH regenerating system incubated for 60 mins by UFLC-MS/MS ana...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of CYP2D6 in human liver microsomes using probe substrate in presence of NADPH regenerating system incubated for 60 mins by UFLC-MS/MS ana...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 9.28E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomes using probe substrate in presence of NADPH regenerating system incubated for 60 mins by UFLC-MS/MS ana...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of CYP2C19 in human liver microsomes using probe substrate in presence of NADPH regenerating system incubated for 60 mins by UFLC-MS/MS an...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of CYP2C9 in human liver microsomes using probe substrate in presence of NADPH regenerating system incubated for 60 mins by UFLC-MS/MS ana...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.68E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomes using probe substrate in presence of NADPH regenerating system incubated for 60 mins by UFLC-MS/MS ana...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 11(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of N-terminal FLAG-tagged full length human HDAC11 expressed in baculovirus infected sf9 cells using Ac-peptide-AMC as substrate incubated...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetPolyamine deacetylase HDAC10(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal FLAG-tagged full length human HDAC10 (2 to 631 residues) expressed in baculovirus infected sf9 cells using Ac-peptide-AMC as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of HDAC1 (unknown origin) using Ac-peptide-AMC as substrate incubated for 1 hr by fluorescence methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 8(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of C-terminal GST-tagged full length human HDAC8 (518 to end residues) expressed in baculovirus expression system using Ac-peptide-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 7(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged full length human HDAC7 (518 to end residues) expressed in baculovirus expression system using Ac-peptide-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 5(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged full length human HDAC5 (627 to 1084 residues) expressed in baculovirus expression system using Ac-peptide-AMC as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 4(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of N-terminal GST-tagged/C-terminal His-tagged human HDAC4 (627 to 1084 residues) expressed in baculovirus expression system using Ac-pept...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of C-terminal His-tagged recombinant human HDAC3 (1 to 428 residues)/N-terminal GST-tagged recombinant human NCoR2 (395 to 489 residues) c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 2(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human HDAC2 using Ac-peptide-AMC as substrate incubated for 1 hr by fluorescence methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed
TargetHistone deacetylase 6(Human)
West China Hospital of Sichuan University

Curated by ChEMBL
LigandPNGBDBM50579542(CHEMBL4878408)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of HDAC6 (unknown origin) using Ac-peptide-AMC as substrate incubated for 1 hr by fluorescence methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2022
Entry Details Article
PubMed