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BDBM50398717 CHEMBL2179246::US10227295, Compound 8c::US9409858, 8c::US9751832, Compound 8c::US9956192, Compound 8c

SMILES: CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1

InChI Key: InChIKey=ARQAMTJPUBWYEU-UHFFFAOYSA-N

Data: 10 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50398717   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 1.36E+3n/an/an/an/a8.0n/a



H. Lee Moffitt Cancer Center and Research Institute, Inc.; Board of Trustees of the University of Illinois

US Patent


Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


US Patent US9409858 (2016)


BindingDB Entry DOI: 10.7270/Q21V5CWN
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 41.1n/an/an/an/a8.0n/a



H. Lee Moffitt Cancer Center and Research Institute, Inc.; Board of Trustees of the University of Illinois

US Patent


Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


US Patent US9409858 (2016)


BindingDB Entry DOI: 10.7270/Q21V5CWN
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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Article
PubMed
n/an/a 41.1n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6 expressed in Sf9 cells incubated for 2 hrs using RHKK-Ac fluorogenic substrate


J Med Chem 55: 9891-9 (2012)


Article DOI: 10.1021/jm301098e
BindingDB Entry DOI: 10.7270/Q2WQ04XP
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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Article
PubMed
n/an/a 1.36E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1 expressed in Sf9 cells incubated for 2 hrs using RHKK-Ac fluorogenic substrate


J Med Chem 55: 9891-9 (2012)


Article DOI: 10.1021/jm301098e
BindingDB Entry DOI: 10.7270/Q2WQ04XP
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 41.1n/an/an/an/an/an/a



KuDOS Pharmaceuticals Ltd.



Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


J Med Chem 51: 6581-91 (2008)


BindingDB Entry DOI: 10.7270/Q2BZ68CW
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 41.1n/an/an/an/an/an/a



H. Lee Moffitt Cancer Center and Research Institute, Inc.; Board of Trustees of the University of Illinois

US Patent


Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


US Patent US9751832 (2017)


BindingDB Entry DOI: 10.7270/Q23T9KBR
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 1.36E+3n/an/an/an/an/an/a



Vernalis (R&D) Ltd



Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


J Med Chem 51: 196-218 (2008)


BindingDB Entry DOI: 10.7270/Q2VD71RF
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 41.1n/an/an/an/an/an/a



Vernalis (R&D) Ltd



Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


J Med Chem 51: 196-218 (2008)


BindingDB Entry DOI: 10.7270/Q2VD71RF
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 1.36E+3n/an/an/an/an/an/a



KuDOS Pharmaceuticals Ltd.



Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


J Med Chem 51: 6581-91 (2008)


BindingDB Entry DOI: 10.7270/Q2BZ68CW
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50398717
PNG
(CHEMBL2179246 | US10227295, Compound 8c | US940985...)
Show SMILES CCN(C(=O)NCc1ccc(cc1)C(=O)NO)c1ccccc1
Show InChI InChI=1S/C17H19N3O3/c1-2-20(15-6-4-3-5-7-15)17(22)18-12-13-8-10-14(11-9-13)16(21)19-23/h3-11,23H,2,12H2,1H3,(H,18,22)(H,19,21)
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US Patent
n/an/a 1.36E+3n/an/an/an/an/an/a



H. Lee Moffitt Cancer Center and Research Institute, Inc.; Board of Trustees of the University of Illinois

US Patent


Assay Description
HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...


US Patent US9751832 (2017)


BindingDB Entry DOI: 10.7270/Q23T9KBR
More data for this
Ligand-Target Pair