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BDBM154551 3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfonamide (7)

SMILES: CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1

InChI Key: InChIKey=RODGWPYKZDULCB-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 = 154551   
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
Methyl-lysine binding protein (53BP1)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
PDB
MMDB

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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
Chromobox protein homolog 7 (CBX7)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
PHD finger protein 1 (PHF1)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
MBT domain-containing protein 1 (MBTD1)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
PDB

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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
PHD finger protein 23 (PHF23)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase (UHRF1)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
PDB

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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
PDB

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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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UniChem
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n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair
PHD finger protein 19 (PHF19)


(Homo sapiens (Human))
BDBM154551
PNG
(3-Bromo-N-(3-(tert-butylamino)propyl)benzenesulfon...)
Show SMILES CC(C)(C)NCCCNS(=O)(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H21BrN2O2S/c1-13(2,3)15-8-5-9-16-19(17,18)12-7-4-6-11(14)10-12/h4,6-7,10,15-16H,5,8-9H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/a8.01,390.75



University of North Carolina at Chapel Hill



Assay Description
In brief, compound plates (1 μL at 10 mM highest concentration; 3-fold, 10-point dilutions in DMSO) were diluted in 1X assay buffer (20 mM TRIS ...


ACS Chem Biol 10: 1072-81 (2015)


Article DOI: 10.1021/cb500956g
BindingDB Entry DOI: 10.7270/Q27S7MHJ
More data for this
Ligand-Target Pair