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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 209458   
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))		BDBM209458
PNG
(US10328074, Example II-2 | US11077107, Example II-...)
Show SMILES CNc1nc(cn2c(C)nnc12)-c1nc(C)c(C)n1Cc1ccccc1
Show InChI InChI=1S/C19H21N7/c1-12-13(2)25(10-15-8-6-5-7-9-15)18(21-12)16-11-26-14(3)23-24-19(26)17(20-4)22-16/h5-9,11H,10H2,1-4H3,(H,20,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 15n/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))		BDBM209458
PNG
(US10328074, Example II-2 | US11077107, Example II-...)
Show SMILES CNc1nc(cn2c(C)nnc12)-c1nc(C)c(C)n1Cc1ccccc1
Show InChI InChI=1S/C19H21N7/c1-12-13(2)25(10-15-8-6-5-7-9-15)18(21-12)16-11-26-14(3)23-24-19(26)17(20-4)22-16/h5-9,11H,10H2,1-4H3,(H,20,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 15n/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


(Homo sapiens (Human))		BDBM209458
PNG
(US10328074, Example II-2 | US11077107, Example II-...)
Show SMILES CNc1nc(cn2c(C)nnc12)-c1nc(C)c(C)n1Cc1ccccc1
Show InChI InChI=1S/C19H21N7/c1-12-13(2)25(10-15-8-6-5-7-9-15)18(21-12)16-11-26-14(3)23-24-19(26)17(20-4)22-16/h5-9,11H,10H2,1-4H3,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Displacement of biotinylated tetra-acetylated histone H4 peptide from GST-tagged BRD4-BD1 (44 to 168 residues) (unknown origin) measured after 30 min...

ACS Med Chem Lett 7: 728-9 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00259
BindingDB Entry DOI: 10.7270/Q20005MR
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 [42-168]


(Homo sapiens (Human))		BDBM209458
PNG
(US10328074, Example II-2 | US11077107, Example II-...)
Show SMILES CNc1nc(cn2c(C)nnc12)-c1nc(C)c(C)n1Cc1ccccc1
Show InChI InChI=1S/C19H21N7/c1-12-13(2)25(10-15-8-6-5-7-9-15)18(21-12)16-11-26-14(3)23-24-19(26)17(20-4)22-16/h5-9,11H,10H2,1-4H3,(H,20,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 15n/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