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16 similar compounds to monomer 50155851

Compile data set for download or QSAR
Wt: 397.5
BDBM50275860
Wt: 413.5
BDBM50275861
Wt: 443.5
BDBM50275916
Wt: 457.5
BDBM50275917
Wt: 443.5
BDBM50275918
Wt: 352.4
BDBM50155845
Wt: 358.4
BDBM50155846
Wt: 370.3
BDBM50155848
Wt: 370.3
BDBM50155849
Wt: 431.3
BDBM50155850
Wt: 388.3
BDBM50155853
Wt: 421.2
BDBM50155854
Wt: 425.4
BDBM50155844
Wt: 345.3
BDBM50155843
Wt: 404.8
BDBM50155852
Displayed 1 to 15 (of 16 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 23 hits for monomerid = 50275860,50275861,50275916,50275917,50275918,50155845,50155846,50155848,50155849,50155850,50155853,50155854,50155844,50155843,50155852   
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
Estrogen receptor


(Homo sapiens (Human))
BDBM50275860
PNG
(1-{2-[4-(4-Phenyl-2,3-dihydro-benzo[b]oxepin-5-yl)...)
Show SMILES C(CN1CCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1
Show InChI InChI=1S/C27H27NO2/c1-2-7-21(8-3-1)24-15-19-30-26-10-5-4-9-25(26)27(24)22-11-13-23(14-12-22)29-20-18-28-16-6-17-28/h1-5,7-14H,6,15-20H2
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n/an/a 8.77n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM50155843
PNG
(CHEMBL3793034 | US9765054, Compound 50K)
Show SMILES Cc1cnc(nc1)-c1ccc(cc1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO
Show InChI InChI=1S/C21H19N3O2/c1-13-11-22-20(23-12-13)16-9-7-15(8-10-16)18-17(19(18)21(25)24-26)14-5-3-2-4-6-14/h2-12,17-19,26H,1H3,(H,24,25)/t17-,18-,19-/m1/s1
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US Patent
n/an/a 90n/an/an/an/an/an/a



CHDI Foundation Inc

US Patent


Assay Description
5 μl of each solution of 1:20 diluted compound from above is transferred to a clear bottomed, black, 384-well assay plate using the Bravo or the...


US Patent US9765054 (2017)


BindingDB Entry DOI: 10.7270/Q2XW4MZG
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50275916
PNG
(4-{8-Methoxy-5-[4-(2-pyrrolidin-1-yl-ethoxy)-pheny...)
Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCC3)cc2)c1
Show InChI InChI=1S/C28H29NO4/c1-31-24-11-12-26-27(19-24)33-17-13-25(20-3-7-22(30)8-4-20)28(26)21-5-9-23(10-6-21)32-18-16-29-14-2-15-29/h3-12,19,30H,2,13-18H2,1H3
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n/an/a 6.70n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50275917
PNG
(4-{8-Methoxy-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl...)
Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCCC3)cc2)c1
Show InChI InChI=1S/C29H31NO4/c1-32-25-12-13-27-28(20-25)34-18-14-26(21-4-8-23(31)9-5-21)29(27)22-6-10-24(11-7-22)33-19-17-30-15-2-3-16-30/h4-13,20,31H,2-3,14-19H2,1H3
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n/an/a 10.3n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50275918
PNG
(4-(4-Hydroxyphenyl)-5-[4-(2-pyrrolidin-1-yl-ethoxy...)
Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(O)cc2OCC1
Show InChI InChI=1S/C28H29NO4/c30-22-7-3-20(4-8-22)25-13-17-33-27-19-23(31)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-29-14-1-2-15-29/h3-12,19,30-31H,1-2,13-18H2
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n/an/a 8.40n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50275860
PNG
(1-{2-[4-(4-Phenyl-2,3-dihydro-benzo[b]oxepin-5-yl)...)
Show SMILES C(CN1CCC1)Oc1ccc(cc1)C1=C(CCOc2ccccc12)c1ccccc1
Show InChI InChI=1S/C27H27NO2/c1-2-7-21(8-3-1)24-15-19-30-26-10-5-4-9-25(26)27(24)22-11-13-23(14-12-22)29-20-18-28-16-6-17-28/h1-5,7-14H,6,15-20H2
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n/an/a 46.1n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50275861
PNG
(4-{5-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-2,3-dih...)
Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCC3)cc2)c2ccccc2OCC1
Show InChI InChI=1S/C27H27NO3/c29-22-10-6-20(7-11-22)24-14-18-31-26-5-2-1-4-25(26)27(24)21-8-12-23(13-9-21)30-19-17-28-15-3-16-28/h1-2,4-13,29H,3,14-19H2
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n/an/a 5.90n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50275916
PNG
(4-{8-Methoxy-5-[4-(2-pyrrolidin-1-yl-ethoxy)-pheny...)
Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCC3)cc2)c1
Show InChI InChI=1S/C28H29NO4/c1-31-24-11-12-26-27(19-24)33-17-13-25(20-3-7-22(30)8-4-20)28(26)21-5-9-23(10-6-21)32-18-16-29-14-2-15-29/h3-12,19,30H,2,13-18H2,1H3
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n/an/a 4.61n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50275917
PNG
(4-{8-Methoxy-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl...)
Show SMILES COc1ccc2c(OCCC(c3ccc(O)cc3)=C2c2ccc(OCCN3CCCC3)cc2)c1
Show InChI InChI=1S/C29H31NO4/c1-32-25-12-13-27-28(20-25)34-18-14-26(21-4-8-23(31)9-5-21)29(27)22-6-10-24(11-7-22)33-19-17-30-15-2-3-16-30/h4-13,20,31H,2-3,14-19H2,1H3
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n/an/a 3.63n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50275918
PNG
(4-(4-Hydroxyphenyl)-5-[4-(2-pyrrolidin-1-yl-ethoxy...)
Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(O)cc2OCC1
Show InChI InChI=1S/C28H29NO4/c30-22-7-3-20(4-8-22)25-13-17-33-27-19-23(31)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-29-14-1-2-15-29/h3-12,19,30-31H,1-2,13-18H2
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n/an/a 2.90n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50155844
PNG
(CHEMBL3787383)
Show SMILES Cc1ccc2n(Cc3cccc(NC(=O)OCCCN4CCOCC4)c3)c(=O)oc2c1
Show InChI InChI=1S/C23H27N3O5/c1-17-6-7-20-21(14-17)31-23(28)26(20)16-18-4-2-5-19(15-18)24-22(27)30-11-3-8-25-9-12-29-13-10-25/h2,4-7,14-15H,3,8-13,16H2,1H3,(H,24,27)
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n/an/a<10n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His-tagged human recombinant c-MET expressed in baculovirus infected Sf21 cells using poly Ala-Glu-Lys-Tyr (6:2:5:1) as sub...


Eur J Med Chem 115: 191-200 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.027
BindingDB Entry DOI: 10.7270/Q28K7BZ9
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM50155843
PNG
(CHEMBL3793034 | US9765054, Compound 50K)
Show SMILES Cc1cnc(nc1)-c1ccc(cc1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO
Show InChI InChI=1S/C21H19N3O2/c1-13-11-22-20(23-12-13)16-9-7-15(8-10-16)18-17(19(18)21(25)24-26)14-5-3-2-4-6-14/h2-12,17-19,26H,1H3,(H,24,25)/t17-,18-,19-/m1/s1
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n/an/a 180n/an/an/an/an/an/a



BioFocus

Curated by ChEMBL


Assay Description
Inhibition of HDAC4 in human Jurkat E6-1 cells using Lys-TFA as substrate


ACS Med Chem Lett 7: 34-9 (2016)


Article DOI: 10.1021/acsmedchemlett.5b00302
BindingDB Entry DOI: 10.7270/Q22Z17DJ
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155853
PNG
(CHEMBL3780059)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(F)cc4F)ccc1c23
Show InChI InChI=1S/C19H14F2N2O3S/c1-2-23-16-8-7-15(12-4-3-5-13(18(12)16)19(23)24)22-27(25,26)17-9-6-11(20)10-14(17)21/h3-10,22H,2H2,1H3
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n/an/an/a 275n/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Binding affinity to human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells by isothermal titration...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155848
PNG
(CHEMBL3780128)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(F)cc4)ccc1c23
Show InChI InChI=1S/C19H15FN2O3S/c1-2-22-17-11-10-16(14-4-3-5-15(18(14)17)19(22)23)21-26(24,25)13-8-6-12(20)7-9-13/h3-11,21H,2H2,1H3
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n/an/an/a 390n/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Binding affinity to human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells by isothermal titration...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155845
PNG
(CHEMBL1485571)
Show SMILES CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C19H16N2O3S/c1-2-21-16-11-12-17(14-9-6-10-15(18(14)16)19(21)22)25(23,24)20-13-7-4-3-5-8-13/h3-12,20H,2H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155852
PNG
(CHEMBL3780753)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(Cl)cc4F)ccc1c23
Show InChI InChI=1S/C19H14ClFN2O3S/c1-2-23-16-8-7-15(12-4-3-5-13(18(12)16)19(23)24)22-27(25,26)17-9-6-11(20)10-14(17)21/h3-10,22H,2H2,1H3
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n/an/a 1.72E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155853
PNG
(CHEMBL3780059)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(F)cc4F)ccc1c23
Show InChI InChI=1S/C19H14F2N2O3S/c1-2-23-16-8-7-15(12-4-3-5-13(18(12)16)19(23)24)22-27(25,26)17-9-6-11(20)10-14(17)21/h3-10,22H,2H2,1H3
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n/an/a 120n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155854
PNG
(CHEMBL3781119)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4c(Cl)cccc4Cl)ccc1c23
Show InChI InChI=1S/C19H14Cl2N2O3S/c1-2-23-16-10-9-15(11-5-3-6-12(17(11)16)19(23)24)22-27(25,26)18-13(20)7-4-8-14(18)21/h3-10,22H,2H2,1H3
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n/an/a 5.56E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155848
PNG
(CHEMBL3780128)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccc(F)cc4)ccc1c23
Show InChI InChI=1S/C19H15FN2O3S/c1-2-22-17-11-10-16(14-4-3-5-15(18(14)17)19(22)23)21-26(24,25)13-8-6-12(20)7-9-13/h3-11,21H,2H2,1H3
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n/an/a 400n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155849
PNG
(CHEMBL3780017)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4cccc(F)c4)ccc1c23
Show InChI InChI=1S/C19H15FN2O3S/c1-2-22-17-10-9-16(14-7-4-8-15(18(14)17)19(22)23)21-26(24,25)13-6-3-5-12(20)11-13/h3-11,21H,2H2,1H3
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n/an/a 620n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155850
PNG
(CHEMBL3781534)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4ccccc4Br)ccc1c23
Show InChI InChI=1S/C19H15BrN2O3S/c1-2-22-16-11-10-15(12-6-5-7-13(18(12)16)19(22)23)21-26(24,25)17-9-4-3-8-14(17)20/h3-11,21H,2H2,1H3
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n/an/a 510n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50155846
PNG
(CHEMBL3779900)
Show SMILES CCN1C(=O)c2cccc3c(NS(=O)(=O)c4cccs4)ccc1c23
Show InChI InChI=1S/C17H14N2O3S2/c1-2-19-14-9-8-13(18-24(21,22)15-7-4-10-23-15)11-5-3-6-12(16(11)14)17(19)20/h3-10,18H,2H2,1H3
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n/an/a 1.19E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of human His6-tagged BRD4 bromodomain 1 (N44 to E168 residues) expressed in Escherichia coli BL21(DE3) cells using biotin-H4KAc4 as substr...


J Med Chem 59: 1565-79 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01511
BindingDB Entry DOI: 10.7270/Q2N87CPF
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50275861
PNG
(4-{5-[4-(2-Pyrrolidin-1-yl-ethoxy)-phenyl]-2,3-dih...)
Show SMILES Oc1ccc(cc1)C1=C(c2ccc(OCCN3CCC3)cc2)c2ccccc2OCC1
Show InChI InChI=1S/C27H27NO3/c29-22-10-6-20(7-11-22)24-14-18-31-26-5-2-1-4-25(26)27(24)21-8-12-23(13-9-21)30-19-17-28-15-3-16-28/h1-2,4-13,29H,3,14-19H2
PDB

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n/an/a 1.90n/an/an/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...


Bioorg Med Chem 16: 9554-73 (2008)


Article DOI: 10.1016/j.bmc.2008.09.035
BindingDB Entry DOI: 10.7270/Q2MW2GZ8
More data for this
Ligand-Target Pair