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6 similar compounds to monomer 50071105

Compile data set for download or QSAR
Wt: 367.4
BDBM50071099
Wt: 423.5
BDBM50071102
Wt: 409.5
BDBM50071103
Wt: 421.5
BDBM50071104
Wt: 353.4
BDBM50071106
Wt: 339.4
BDBM50071107

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50071099,50071102,50071103,50071104,50071106,50071107   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071099
PNG
(CHEMBL3410009)
Show SMILES CNc1cc(cc(c1C)S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C16H21N3O3S2/c1-10-13(17-2)7-11(14-9-23-16(20)18-14)8-15(10)24(21,22)19-12-5-3-4-6-12/h7-9,12,17,19H,3-6H2,1-2H3,(H,18,20)
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n/an/a 250n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of BRD4(1) (unknown origin) incubated for 4 hrs by (+)-JQ1 fluorescent ligand based fluorescence anisotrophy


J Med Chem 58: 1281-97 (2015)


Article DOI: 10.1021/jm501504k
BindingDB Entry DOI: 10.7270/Q2P270TX
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071102
PNG
(CHEMBL3410006)
Show SMILES CCCC(=O)Nc1cc(cc(c1C)S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C19H25N3O4S2/c1-3-6-18(23)20-15-9-13(16-11-27-19(24)21-16)10-17(12(15)2)28(25,26)22-14-7-4-5-8-14/h9-11,14,22H,3-8H2,1-2H3,(H,20,23)(H,21,24)
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n/an/a 930n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of BRD4(1) (unknown origin) incubated for 4 hrs by (+)-JQ1 fluorescent ligand based fluorescence anisotrophy


J Med Chem 58: 1281-97 (2015)


Article DOI: 10.1021/jm501504k
BindingDB Entry DOI: 10.7270/Q2P270TX
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071103
PNG
(CHEMBL3410005)
Show SMILES CCCC(=O)Nc1cc(cc(c1)S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C18H23N3O4S2/c1-2-5-17(22)19-14-8-12(16-11-26-18(23)20-16)9-15(10-14)27(24,25)21-13-6-3-4-7-13/h8-11,13,21H,2-7H2,1H3,(H,19,22)(H,20,23)
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n/an/a 170n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of BRD4(1) (unknown origin) incubated for 4 hrs by (+)-JQ1 fluorescent ligand based fluorescence anisotrophy


J Med Chem 58: 1281-97 (2015)


Article DOI: 10.1021/jm501504k
BindingDB Entry DOI: 10.7270/Q2P270TX
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071106
PNG
(CHEMBL3410002)
Show SMILES Cc1c(N)cc(cc1S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C15H19N3O3S2/c1-9-12(16)6-10(13-8-22-15(19)17-13)7-14(9)23(20,21)18-11-4-2-3-5-11/h6-8,11,18H,2-5,16H2,1H3,(H,17,19)
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n/an/a 140n/an/an/an/an/an/a



Hebei University

Curated by ChEMBL


Assay Description
Inhibition of BRD4 (unknown origin) by Alphascreen assay


Eur J Med Chem 152: 264-273 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.048
BindingDB Entry DOI: 10.7270/Q2T43WP9
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071106
PNG
(CHEMBL3410002)
Show SMILES Cc1c(N)cc(cc1S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C15H19N3O3S2/c1-9-12(16)6-10(13-8-22-15(19)17-13)7-14(9)23(20,21)18-11-4-2-3-5-11/h6-8,11,18H,2-5,16H2,1H3,(H,17,19)
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n/an/a 140n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of BRD4(1) (unknown origin) incubated for 4 hrs by (+)-JQ1 fluorescent ligand based fluorescence anisotrophy


J Med Chem 58: 1281-97 (2015)


Article DOI: 10.1021/jm501504k
BindingDB Entry DOI: 10.7270/Q2P270TX
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071107
PNG
(CHEMBL3410001)
Show SMILES Nc1cc(cc(c1)S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C14H17N3O3S2/c15-10-5-9(13-8-21-14(18)16-13)6-12(7-10)22(19,20)17-11-3-1-2-4-11/h5-8,11,17H,1-4,15H2,(H,16,18)
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n/an/a 460n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of BRD4(1) (unknown origin) incubated for 4 hrs by (+)-JQ1 fluorescent ligand based fluorescence anisotrophy


J Med Chem 58: 1281-97 (2015)


Article DOI: 10.1021/jm501504k
BindingDB Entry DOI: 10.7270/Q2P270TX
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50071104
PNG
(CHEMBL3410004)
Show SMILES Cc1c(NC(=O)C2CC2)cc(cc1S(=O)(=O)NC1CCCC1)-c1csc(=O)[nH]1
Show InChI InChI=1S/C19H23N3O4S2/c1-11-15(20-18(23)12-6-7-12)8-13(16-10-27-19(24)21-16)9-17(11)28(25,26)22-14-4-2-3-5-14/h8-10,12,14,22H,2-7H2,1H3,(H,20,23)(H,21,24)
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n/an/a 220n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of BRD4(1) (unknown origin) incubated for 4 hrs by (+)-JQ1 fluorescent ligand based fluorescence anisotrophy


J Med Chem 58: 1281-97 (2015)


Article DOI: 10.1021/jm501504k
BindingDB Entry DOI: 10.7270/Q2P270TX
More data for this
Ligand-Target Pair