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PubMed code 23517011

Compile data set for download or QSAR
Found 29 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50365262
PNG
((+)-JQ1 | (S)-JQ1 (1) | CHEMBL1957266 | JQ1 | US10...)
Show SMILES Cc1nnc2[C@H](CC(=O)OC(C)(C)C)N=C(c3c(C)c(C)sc3-n12)c1ccc(Cl)cc1 |r,c:14|
Show InChI InChI=1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3/t17-/m0/s1
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n/an/a 77n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430826
PNG
(CHEMBL2335155)
Show SMILES Cc1noc(C)c1-c1ccc2ncn(Cc3ccc(cc3)C#N)c2c1
Show InChI InChI=1S/C20H16N4O/c1-13-20(14(2)25-23-13)17-7-8-18-19(9-17)24(12-22-18)11-16-5-3-15(10-21)4-6-16/h3-9,12H,11H2,1-2H3
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n/an/a 180n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50399434
PNG
(CHEMBL2179387)
Show SMILES COc1ccccc1S(=O)(=O)Nc1ccc2NC(=O)N(C)Cc2c1
Show InChI InChI=1S/C16H17N3O4S/c1-19-10-11-9-12(7-8-13(11)17-16(19)20)18-24(21,22)15-6-4-3-5-14(15)23-2/h3-9,18H,10H2,1-2H3,(H,17,20)
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n/an/a 220n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430836
PNG
(CHEMBL2335153)
Show SMILES CC(=O)Oc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C20H19NO4/c1-12-19(13(2)25-21-12)16-9-17(11-18(10-16)24-14(3)22)20(23)15-7-5-4-6-8-15/h4-11,20,23H,1-3H3
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n/an/a 371n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430837
PNG
(CHEMBL2335154)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)[C@@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3/t18-/m0/s1
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n/an/a 382n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430827
PNG
(CHEMBL2335147)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)[C@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3/t18-/m1/s1
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n/an/a 386n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430838
PNG
(CHEMBL2335146)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C18H15NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,20H,1-2H3
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n/an/a 544n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430835
PNG
(CHEMBL2335152)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C20H21NO3/c1-4-23-18-11-16(19-13(2)21-24-14(19)3)10-17(12-18)20(22)15-8-6-5-7-9-15/h5-12,20,22H,4H2,1-3H3
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n/an/a 640n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430837
PNG
(CHEMBL2335154)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)[C@@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3/t18-/m0/s1
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n/an/a 771n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430827
PNG
(CHEMBL2335147)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)[C@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3/t18-/m1/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430830
PNG
(CHEMBL2335145)
Show SMILES Cc1noc(C)c1-c1cc(OCCO)cc(c1)C(O)c1ccccc1
Show InChI InChI=1S/C20H21NO4/c1-13-19(14(2)25-21-13)16-10-17(12-18(11-16)24-9-8-22)20(23)15-6-4-3-5-7-15/h3-7,10-12,20,22-23H,8-9H2,1-2H3
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n/an/a 1.17E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430829
PNG
(CHEMBL2331593)
Show SMILES COc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C19H19NO3/c1-12-18(13(2)23-20-12)15-9-16(11-17(10-15)22-3)19(21)14-7-5-4-6-8-14/h4-11,19,21H,1-3H3
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n/an/a 1.36E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430828
PNG
(CHEMBL2335144)
Show SMILES COCCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C21H23NO4/c1-14-20(15(2)26-22-14)17-11-18(13-19(12-17)25-10-9-24-3)21(23)16-7-5-4-6-8-16/h4-8,11-13,21,23H,9-10H2,1-3H3
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n/an/a 1.38E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430834
PNG
(CHEMBL2335151)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccc(F)cc1
Show InChI InChI=1S/C20H20FNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)9-16(11-18)20(23)14-5-7-17(21)8-6-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430833
PNG
(CHEMBL2335149)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1cccc(F)c1
Show InChI InChI=1S/C20H20FNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)8-16(11-18)20(23)14-6-5-7-17(21)9-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430828
PNG
(CHEMBL2335144)
Show SMILES COCCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C21H23NO4/c1-14-20(15(2)26-22-14)17-11-18(13-19(12-17)25-10-9-24-3)21(23)16-7-5-4-6-8-16/h4-8,11-13,21,23H,9-10H2,1-3H3
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n/an/a 2.07E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430836
PNG
(CHEMBL2335153)
Show SMILES CC(=O)Oc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C20H19NO4/c1-12-19(13(2)25-21-12)16-9-17(11-18(10-16)24-14(3)22)20(23)15-7-5-4-6-8-15/h4-11,20,23H,1-3H3
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n/an/a 2.48E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430832
PNG
(CHEMBL2335150)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H20ClNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)9-16(11-18)20(23)14-5-7-17(21)8-6-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430830
PNG
(CHEMBL2335145)
Show SMILES Cc1noc(C)c1-c1cc(OCCO)cc(c1)C(O)c1ccccc1
Show InChI InChI=1S/C20H21NO4/c1-13-19(14(2)25-21-13)16-10-17(12-18(11-16)24-9-8-22)20(23)15-6-4-3-5-7-15/h3-7,10-12,20,22-23H,8-9H2,1-2H3
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n/an/a 2.81E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430831
PNG
(CHEMBL2335148)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1cccc(Cl)c1
Show InChI InChI=1S/C20H20ClNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)8-16(11-18)20(23)14-6-5-7-17(21)9-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 3.90E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430829
PNG
(CHEMBL2331593)
Show SMILES COc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C19H19NO3/c1-12-18(13(2)23-20-12)15-9-16(11-17(10-15)22-3)19(21)14-7-5-4-6-8-14/h4-11,19,21H,1-3H3
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n/an/a 3.96E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430835
PNG
(CHEMBL2335152)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccccc1
Show InChI InChI=1S/C20H21NO3/c1-4-23-18-11-16(19-13(2)21-24-14(19)3)10-17(12-18)20(22)15-8-6-5-7-9-15/h5-12,20,22H,4H2,1-3H3
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n/an/a 4.10E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50353596
PNG
(CHEMBL1828986)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(C)O
Show InChI InChI=1S/C15H19NO3/c1-5-18-14-7-12(10(3)17)6-13(8-14)15-9(2)16-19-11(15)4/h6-8,10,17H,5H2,1-4H3
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n/an/a 4.80E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human BRD4 bromodomain 1 using H4Ac4 peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CREB-binding protein


(Homo sapiens (Human))
BDBM50430833
PNG
(CHEMBL2335149)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1cccc(F)c1
Show InChI InChI=1S/C20H20FNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)8-16(11-18)20(23)14-6-5-7-17(21)9-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 6.30E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430831
PNG
(CHEMBL2335148)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1cccc(Cl)c1
Show InChI InChI=1S/C20H20ClNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)8-16(11-18)20(23)14-6-5-7-17(21)9-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 8.50E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430834
PNG
(CHEMBL2335151)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccc(F)cc1
Show InChI InChI=1S/C20H20FNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)9-16(11-18)20(23)14-5-7-17(21)8-6-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 8.60E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM50430832
PNG
(CHEMBL2335150)
Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H20ClNO3/c1-4-24-18-10-15(19-12(2)22-25-13(19)3)9-16(11-18)20(23)14-5-7-17(21)8-6-14/h5-11,20,23H,4H2,1-3H3
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n/an/a 1.08E+4n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to CREBBP bromodomain (unknown origin) using H3K56Ac peptide by amplified luminescent proximity homogeneous assay


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430827
PNG
(CHEMBL2335147)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)[C@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3/t18-/m1/s1
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n/an/an/a 360n/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human N-His-tagged BRD4 bromodomain 1 by surface plasmon resonance analysis


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50430837
PNG
(CHEMBL2335154)
Show SMILES Cc1noc(C)c1-c1cc(O)cc(c1)[C@@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3/t18-/m0/s1
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n/an/an/a 390n/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Binding affinity to human N-His-tagged BRD4 bromodomain 1 by surface plasmon resonance analysis


J Med Chem 56: 3217-27 (2013)


Article DOI: 10.1021/jm301588r
BindingDB Entry DOI: 10.7270/Q2B859GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
* indicates data uncertainty>20%