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BDBM111088 US9695179, 85

SMILES: COc1ccc(Cn2c3ccc(Cl)cc3c(OS(=O)(=O)c3ccc(F)cc3)c(-c3coc(C)n3)c2=O)cc1

InChI Key: InChIKey=ZHMLMIPUXGONAG-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 111088   
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
BRD4-BD1-BD2


(Homo sapiens (Human))		BDBM111088
PNG
(US9695179, 85)
Show SMILES COc1ccc(Cn2c3ccc(Cl)cc3c(OS(=O)(=O)c3ccc(F)cc3)c(-c3coc(C)n3)c2=O)cc1
Show InChI InChI=1S/C27H20ClFN2O6S/c1-16-30-23(15-36-16)25-26(37-38(33,34)21-10-6-19(29)7-11-21)22-13-18(28)5-12-24(22)31(27(25)32)14-17-3-8-20(35-2)9-4-17/h3-13,15H,14H2,1-2H3
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 8.76E+5n/an/an/an/an/a25



ConverGene LLC

US Patent


Assay Description
The interactions between test compounds and BRD4 protein containing both bromodomain 1 and bromodomain 2 were measured with human BRD4 protein with N...

US Patent US9695179 (2017)


BindingDB Entry DOI: 10.7270/Q21G0JF6
More data for this
Ligand-Target Pair