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BDBM249285 US10017501, Compound 1020-74::US9458145, 1020-74

SMILES: Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2n(C)c(nc2c1)C1CC1

InChI Key: InChIKey=MDMMPXBYWBPZAT-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 249285   
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
Bromodomain-containing protein 4 Bromo 1 domain(BRD4 BD1)


(Homo sapiens (Human))
BDBM249285
PNG
(US10017501, Compound 1020-74 | US9458145, 1020-74)
Show SMILES Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2n(C)c(nc2c1)C1CC1 |(-3.94,3.53,;-2.6,4.3,;-2.13,5.77,;-.59,5.77,;-.11,4.3,;1.22,3.53,;-1.36,3.4,;-1.36,1.86,;-.02,1.09,;-.02,-.45,;1.31,-1.22,;1.31,-2.76,;-.02,-3.53,;2.64,-3.53,;3.98,-2.76,;3.98,-1.22,;5.31,-.45,;5.31,1.09,;3.98,1.86,;2.64,1.09,;2.64,-.45,;-1.36,-1.22,;-1.68,-2.73,;-.59,-3.82,;-3.21,-2.89,;-3.83,-1.48,;-2.69,-.45,;-2.69,1.09,;-3.98,-4.23,;-5.31,-5,;-3.98,-5.77,)|
Show InChI InChI=1S/C26H24N4O/c1-14-7-10-21-19(6-5-11-27-21)23(14)20-12-18(24-15(2)29-31-16(24)3)13-22-25(20)30(4)26(28-22)17-8-9-17/h5-7,10-13,17H,8-9H2,1-4H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 97.1n/an/an/an/a7.525



Gilead Sciences, Inc.

US Patent


Assay Description
Binding of the two tandem bromodomains, BRD4-1 and BRD4-2, to an acetylated histone H4 peptide was measured using a homogeneous time resolved fluores...


US Patent US9458145 (2016)


BindingDB Entry DOI: 10.7270/Q26Q1W53
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 Bromo 2 domain(BRD4 BD2)


(Homo sapiens (Human))
BDBM249285
PNG
(US10017501, Compound 1020-74 | US9458145, 1020-74)
Show SMILES Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2n(C)c(nc2c1)C1CC1 |(-3.94,3.53,;-2.6,4.3,;-2.13,5.77,;-.59,5.77,;-.11,4.3,;1.22,3.53,;-1.36,3.4,;-1.36,1.86,;-.02,1.09,;-.02,-.45,;1.31,-1.22,;1.31,-2.76,;-.02,-3.53,;2.64,-3.53,;3.98,-2.76,;3.98,-1.22,;5.31,-.45,;5.31,1.09,;3.98,1.86,;2.64,1.09,;2.64,-.45,;-1.36,-1.22,;-1.68,-2.73,;-.59,-3.82,;-3.21,-2.89,;-3.83,-1.48,;-2.69,-.45,;-2.69,1.09,;-3.98,-4.23,;-5.31,-5,;-3.98,-5.77,)|
Show InChI InChI=1S/C26H24N4O/c1-14-7-10-21-19(6-5-11-27-21)23(14)20-12-18(24-15(2)29-31-16(24)3)13-22-25(20)30(4)26(28-22)17-8-9-17/h5-7,10-13,17H,8-9H2,1-4H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 112n/an/an/an/a7.525



Gilead Sciences, Inc.

US Patent


Assay Description
Binding of the two tandem bromodomains, BRD4-1 and BRD4-2, to an acetylated histone H4 peptide was measured using a homogeneous time resolved fluores...


US Patent US9458145 (2016)


BindingDB Entry DOI: 10.7270/Q26Q1W53
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 Bromo 2 domain(BRD4 BD2)


(Homo sapiens (Human))
BDBM249285
PNG
(US10017501, Compound 1020-74 | US9458145, 1020-74)
Show SMILES Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2n(C)c(nc2c1)C1CC1 |(-3.94,3.53,;-2.6,4.3,;-2.13,5.77,;-.59,5.77,;-.11,4.3,;1.22,3.53,;-1.36,3.4,;-1.36,1.86,;-.02,1.09,;-.02,-.45,;1.31,-1.22,;1.31,-2.76,;-.02,-3.53,;2.64,-3.53,;3.98,-2.76,;3.98,-1.22,;5.31,-.45,;5.31,1.09,;3.98,1.86,;2.64,1.09,;2.64,-.45,;-1.36,-1.22,;-1.68,-2.73,;-.59,-3.82,;-3.21,-2.89,;-3.83,-1.48,;-2.69,-.45,;-2.69,1.09,;-3.98,-4.23,;-5.31,-5,;-3.98,-5.77,)|
Show InChI InChI=1S/C26H24N4O/c1-14-7-10-21-19(6-5-11-27-21)23(14)20-12-18(24-15(2)29-31-16(24)3)13-22-25(20)30(4)26(28-22)17-8-9-17/h5-7,10-13,17H,8-9H2,1-4H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 112n/an/an/an/an/an/a



Gilead Sciences Inc

US Patent


Assay Description
Binding of the two tandem bromodomains, BRD4-1 and BRD4-2, to an acetylated histone H4 peptide was measured using a homogeneous time resolved fluores...


US Patent US10017501 (2018)


BindingDB Entry DOI: 10.7270/Q2CV4M3Z
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 Bromo 1 domain(BRD4 BD1)


(Homo sapiens (Human))
BDBM249285
PNG
(US10017501, Compound 1020-74 | US9458145, 1020-74)
Show SMILES Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2n(C)c(nc2c1)C1CC1 |(-3.94,3.53,;-2.6,4.3,;-2.13,5.77,;-.59,5.77,;-.11,4.3,;1.22,3.53,;-1.36,3.4,;-1.36,1.86,;-.02,1.09,;-.02,-.45,;1.31,-1.22,;1.31,-2.76,;-.02,-3.53,;2.64,-3.53,;3.98,-2.76,;3.98,-1.22,;5.31,-.45,;5.31,1.09,;3.98,1.86,;2.64,1.09,;2.64,-.45,;-1.36,-1.22,;-1.68,-2.73,;-.59,-3.82,;-3.21,-2.89,;-3.83,-1.48,;-2.69,-.45,;-2.69,1.09,;-3.98,-4.23,;-5.31,-5,;-3.98,-5.77,)|
Show InChI InChI=1S/C26H24N4O/c1-14-7-10-21-19(6-5-11-27-21)23(14)20-12-18(24-15(2)29-31-16(24)3)13-22-25(20)30(4)26(28-22)17-8-9-17/h5-7,10-13,17H,8-9H2,1-4H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 97.1n/an/an/an/an/an/a



Gilead Sciences Inc

US Patent


Assay Description
Binding of the two tandem bromodomains, BRD4-1 and BRD4-2, to an acetylated histone H4 peptide was measured using a homogeneous time resolved fluores...


US Patent US10017501 (2018)


BindingDB Entry DOI: 10.7270/Q2CV4M3Z
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 Bromo 1 domain(BRD4 BD1)


(Homo sapiens (Human))
BDBM249285
PNG
(US10017501, Compound 1020-74 | US9458145, 1020-74)
Show SMILES Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2n(C)c(nc2c1)C1CC1 |(-3.94,3.53,;-2.6,4.3,;-2.13,5.77,;-.59,5.77,;-.11,4.3,;1.22,3.53,;-1.36,3.4,;-1.36,1.86,;-.02,1.09,;-.02,-.45,;1.31,-1.22,;1.31,-2.76,;-.02,-3.53,;2.64,-3.53,;3.98,-2.76,;3.98,-1.22,;5.31,-.45,;5.31,1.09,;3.98,1.86,;2.64,1.09,;2.64,-.45,;-1.36,-1.22,;-1.68,-2.73,;-.59,-3.82,;-3.21,-2.89,;-3.83,-1.48,;-2.69,-.45,;-2.69,1.09,;-3.98,-4.23,;-5.31,-5,;-3.98,-5.77,)|
Show InChI InChI=1S/C26H24N4O/c1-14-7-10-21-19(6-5-11-27-21)23(14)20-12-18(24-15(2)29-31-16(24)3)13-22-25(20)30(4)26(28-22)17-8-9-17/h5-7,10-13,17H,8-9H2,1-4H3
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 18.9n/an/an/an/a7.525



Gilead Sciences, Inc.

US Patent


Assay Description
Binding of the bromodomain BRD4-I to an acetylated histone H4 peptide was measured using a bead-based Amplified Luminescent Proximity Homogeneous Ass...


US Patent US9458145 (2016)


BindingDB Entry DOI: 10.7270/Q26Q1W53
More data for this
Ligand-Target Pair