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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 209459   
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 [44-168]/Histone H4


(Homo sapiens (Human))
BDBM209459
PNG
(US10328074, Example II-3 | US11077107, Example II-...)
Show SMILES Cc1nc(-c2cn3c(C)nnc3c(C)n2)n(Cc2ccccc2)c1C
Show InChI InChI=1S/C19H20N6/c1-12-14(3)24(10-16-8-6-5-7-9-16)19(21-12)17-11-25-15(4)22-23-18(25)13(2)20-17/h5-9,11H,10H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 31n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Compounds are diluted in serial dilution 1:5 in assay buffer from 10 mM stock in DMSO (100 uM start concentration) in white OptiPlate-384 (PerkinElme...


US Patent US9266891 (2016)


BindingDB Entry DOI: 10.7270/Q23X85G7
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 [44-168]


(Homo sapiens (Human))
BDBM209459
PNG
(US10328074, Example II-3 | US11077107, Example II-...)
Show SMILES Cc1nc(-c2cn3c(C)nnc3c(C)n2)n(Cc2ccccc2)c1C
Show InChI InChI=1S/C19H20N6/c1-12-14(3)24(10-16-8-6-5-7-9-16)19(21-12)17-11-25-15(4)22-23-18(25)13(2)20-17/h5-9,11H,10H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 31n/an/an/an/an/an/a


TBA

Assay Description
Compounds are diluted in serial dilution 1:5 in assay buffer from 10 mM stock in DMSO (100 μM start concentration) in white OptiPlate-384 (Perki...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2PV6PHQ
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 [42-168]


(Homo sapiens (Human))
BDBM209459
PNG
(US10328074, Example II-3 | US11077107, Example II-...)
Show SMILES Cc1nc(-c2cn3c(C)nnc3c(C)n2)n(Cc2ccccc2)c1C
Show InChI InChI=1S/C19H20N6/c1-12-14(3)24(10-16-8-6-5-7-9-16)19(21-12)17-11-25-15(4)22-23-18(25)13(2)20-17/h5-9,11H,10H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 31n/an/an/an/an/an/a



Duquesne University



Assay Description
This assay is used to determine whether the compounds inhibit the interaction between the first (BRD4-BD1) or the second (BRD4-BD2) bromodomain of BR...


Bioorg Med Chem 17: 7324-36 (2009)


BindingDB Entry DOI: 10.7270/Q20Z75M2
More data for this
Ligand-Target Pair