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Compile Data Set for Download or QSAR

Found 29 hits with Last Name = 'patel' and Initial = 'rg'   
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))
BDBM50463896
PNG
(CHEMBL4244412)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccccc3)c2c1
Show InChI InChI=1S/C19H18N4O/c1-12-18(13(2)24-22-12)15-8-16(20)19-17(9-15)23(11-21-19)10-14-6-4-3-5-7-14/h3-9,11H,10,20H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 1 hr by alpha-screen ass...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463896
PNG
(CHEMBL4244412)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccccc3)c2c1
Show InChI InChI=1S/C19H18N4O/c1-12-18(13(2)24-22-12)15-8-16(20)19-17(9-15)23(11-21-19)10-14-6-4-3-5-7-14/h3-9,11H,10,20H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463897
PNG
(CHEMBL4241205)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccc(cc3)C3CO3)c2c1
Show InChI InChI=1S/C21H20N4O2/c1-12-20(13(2)27-24-12)16-7-17(22)21-18(8-16)25(11-23-21)9-14-3-5-15(6-4-14)19-10-26-19/h3-8,11,19H,9-10,22H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 4 hrs by alpha-screen as...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463896
PNG
(CHEMBL4244412)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccccc3)c2c1
Show InChI InChI=1S/C19H18N4O/c1-12-18(13(2)24-22-12)15-8-16(20)19-17(9-15)23(11-21-19)10-14-6-4-3-5-7-14/h3-9,11H,10,20H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 5 mins by alpha-screen a...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463896
PNG
(CHEMBL4244412)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccccc3)c2c1
Show InChI InChI=1S/C19H18N4O/c1-12-18(13(2)24-22-12)15-8-16(20)19-17(9-15)23(11-21-19)10-14-6-4-3-5-7-14/h3-9,11H,10,20H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 4 hrs by alpha-screen as...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463896
PNG
(CHEMBL4244412)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccccc3)c2c1
Show InChI InChI=1S/C19H18N4O/c1-12-18(13(2)24-22-12)15-8-16(20)19-17(9-15)23(11-21-19)10-14-6-4-3-5-7-14/h3-9,11H,10,20H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50365463
PNG
(CHEMBL1232461)
Show SMILES CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|
Show InChI InChI=1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m0/s1
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463898
PNG
(CHEMBL4241469)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2cccc(F)c2)c1
Show InChI InChI=1S/C17H15FN2O2/c1-11-17(12(2)22-19-11)14-6-7-16(21)20(10-14)9-13-4-3-5-15(18)8-13/h3-8,10H,9H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50365463
PNG
(CHEMBL1232461)
Show SMILES CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|
Show InChI InChI=1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m0/s1
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50365463
PNG
(CHEMBL1232461)
Show SMILES CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|
Show InChI InChI=1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m0/s1
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463897
PNG
(CHEMBL4241205)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccc(cc3)C3CO3)c2c1
Show InChI InChI=1S/C21H20N4O2/c1-12-20(13(2)27-24-12)16-7-17(22)21-18(8-16)25(11-23-21)9-14-3-5-15(6-4-14)19-10-26-19/h3-8,11,19H,9-10,22H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463896
PNG
(CHEMBL4244412)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccccc3)c2c1
Show InChI InChI=1S/C19H18N4O/c1-12-18(13(2)24-22-12)15-8-16(20)19-17(9-15)23(11-21-19)10-14-6-4-3-5-7-14/h3-9,11H,10,20H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
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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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463897
PNG
(CHEMBL4241205)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccc(cc3)C3CO3)c2c1
Show InChI InChI=1S/C21H20N4O2/c1-12-20(13(2)27-24-12)16-7-17(22)21-18(8-16)25(11-23-21)9-14-3-5-15(6-4-14)19-10-26-19/h3-8,11,19H,9-10,22H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463897
PNG
(CHEMBL4241205)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccc(cc3)C3CO3)c2c1
Show InChI InChI=1S/C21H20N4O2/c1-12-20(13(2)27-24-12)16-7-17(22)21-18(8-16)25(11-23-21)9-14-3-5-15(6-4-14)19-10-26-19/h3-8,11,19H,9-10,22H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
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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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463897
PNG
(CHEMBL4241205)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccc(cc3)C3CO3)c2c1
Show InChI InChI=1S/C21H20N4O2/c1-12-20(13(2)27-24-12)16-7-17(22)21-18(8-16)25(11-23-21)9-14-3-5-15(6-4-14)19-10-26-19/h3-8,11,19H,9-10,22H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 1 hr by alpha-screen ass...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463900
PNG
(CHEMBL4251258)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccccc2)c1
Show InChI InChI=1S/C17H16N2O2/c1-12-17(13(2)21-18-12)15-8-9-16(20)19(11-15)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463895
PNG
(CHEMBL4243172)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(C3CO3)c(F)c2)c1
Show InChI InChI=1S/C19H17FN2O3/c1-11-19(12(2)25-21-11)14-4-6-18(23)22(9-14)8-13-3-5-15(16(20)7-13)17-10-24-17/h3-7,9,17H,8,10H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463895
PNG
(CHEMBL4243172)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(C3CO3)c(F)c2)c1
Show InChI InChI=1S/C19H17FN2O3/c1-11-19(12(2)25-21-11)14-4-6-18(23)22(9-14)8-13-3-5-15(16(20)7-13)17-10-24-17/h3-7,9,17H,8,10H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463899
PNG
(CHEMBL4246969)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(cc2)C2CO2)c1
Show InChI InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463900
PNG
(CHEMBL4251258)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccccc2)c1
Show InChI InChI=1S/C17H16N2O2/c1-12-17(13(2)21-18-12)15-8-9-16(20)19(11-15)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463897
PNG
(CHEMBL4241205)
Show SMILES Cc1noc(C)c1-c1cc(N)c2ncn(Cc3ccc(cc3)C3CO3)c2c1
Show InChI InChI=1S/C21H20N4O2/c1-12-20(13(2)27-24-12)16-7-17(22)21-18(8-16)25(11-23-21)9-14-3-5-15(6-4-14)19-10-26-19/h3-8,11,19H,9-10,22H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 5 mins by alpha-screen a...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463900
PNG
(CHEMBL4251258)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccccc2)c1
Show InChI InChI=1S/C17H16N2O2/c1-12-17(13(2)21-18-12)15-8-9-16(20)19(11-15)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3
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n/an/a 280n/an/an/an/an/an/a



Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463899
PNG
(CHEMBL4246969)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(cc2)C2CO2)c1
Show InChI InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3
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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463899
PNG
(CHEMBL4246969)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2ccc(cc2)C2CO2)c1
Show InChI InChI=1S/C19H18N2O3/c1-12-19(13(2)24-20-12)16-7-8-18(22)21(10-16)9-14-3-5-15(6-4-14)17-11-23-17/h3-8,10,17H,9,11H2,1-2H3
PDB

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Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463898
PNG
(CHEMBL4241469)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2cccc(F)c2)c1
Show InChI InChI=1S/C17H15FN2O2/c1-11-17(12(2)22-19-11)14-6-7-16(21)20(10-14)9-13-4-3-5-15(18)8-13/h3-8,10H,9H2,1-2H3
PDB

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n/an/a 1.07E+3n/an/an/an/an/an/a



Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-screen ...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM50463898
PNG
(CHEMBL4241469)
Show SMILES Cc1noc(C)c1-c1ccc(=O)n(Cc2cccc(F)c2)c1
Show InChI InChI=1S/C17H15FN2O2/c1-11-17(12(2)22-19-11)14-6-7-16(21)20(10-14)9-13-4-3-5-15(18)8-13/h3-8,10H,9H2,1-2H3
PDB

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n/an/a 1.41E+3n/an/an/an/an/an/a



Zenith Epigenetics

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged BRD4 (BD1/BD2) (unknown origin) using biotinylated tetra-acetylated histone H4 peptide after 30 mins by alpha-scr...


J Med Chem 61: 8202-8211 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00666
BindingDB Entry DOI: 10.7270/Q2F76G6T
More data for this
Ligand-Target Pair