BDBM50399006 CHEMBL2177587

SMILES CN1C[C@@H]([C@H](C1)c1ccc(\C=C\C(=O)Nc2ccccc2N)cc1)C(=O)Nc1ccc(Cl)cc1

InChI Key InChIKey=CTJRRDKOXVXXEW-HNAOKYFASA-N

Data  17 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50399006   

TargetHistone deacetylase 1(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  60nMAssay Description:Inhibition of HDAC1 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 2(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  250nMAssay Description:Inhibition of HDAC2 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 1A2(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  4.20E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomes in presence of NADPH by LC-MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  4.30E+4nMAssay Description:Inhibition of CYP2C19 in human liver microsomes in presence of NADPH by LC-MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  2.90E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsomes in presence of NADPH by LC-MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  5.00E+3nMAssay Description:Inhibition of CYP2D6 in human liver microsomes in presence of NADPH by LC-MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  1.40E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomes in presence of NADPH by LC-MS/MS methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 11(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  1.40E+4nMAssay Description:Inhibition of HDAC11 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPolyamine deacetylase HDAC10(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  3.40E+3nMAssay Description:Inhibition of HDAC10 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 9(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  1.60E+4nMAssay Description:Inhibition of HDAC9 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 8(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of HDAC8 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 7(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of HDAC7 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 6(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of HDAC6 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 5(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  3.50E+3nMAssay Description:Inhibition of HDAC5 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 4(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  1.30E+4nMAssay Description:Inhibition of HDAC4 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistone deacetylase 3(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  230nMAssay Description:Inhibition of HDAC3 using p53 (379 to 382 residues) based fluorogenic peptide substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPotassium voltage-gated channel subfamily H member 2(Homo sapiens (Human))
Roche R & D Center China

Curated by ChEMBL
LigandPNGBDBM50399006(CHEMBL2177587)
Affinity DataIC50:  1.00E+4nMAssay Description:Inhibition of human ERG expressed in CHO cells by patch clamp methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed