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SMILES: COc1cc(ccc1-n1cnc(C)c1)-c1cn(Cc2cc(Br)cc(Br)c2)nn1

InChI Key: InChIKey=VRZIEXXJAZACPZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50350777   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50350777
PNG
(CHEMBL1818827)
Show SMILES COc1cc(ccc1-n1cnc(C)c1)-c1cn(Cc2cc(Br)cc(Br)c2)nn1
Show InChI InChI=1S/C20H17Br2N5O/c1-13-9-26(12-23-13)19-4-3-15(7-20(19)28-2)18-11-27(25-24-18)10-14-5-16(21)8-17(22)6-14/h3-9,11-12H,10H2,1-2H3
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Merck Research Laboratories Boston

Curated by ChEMBL


Assay Description
Binding affinity to human ERG by radioligand displacement assay

Bioorg Med Chem Lett 21: 4083-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.089
BindingDB Entry DOI: 10.7270/Q2Z3201J
More data for this
Ligand-Target Pair