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BDBM50352069 CHEMBL1824037

SMILES: [O-][N+](=O)c1ccc2OCC(=O)N(CCN3CCC(CC3)NCc3ccc4OCC(=O)Nc4n3)c2c1

InChI Key: InChIKey=VEXIRMNIIKRZHJ-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50352069   
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))
BDBM50352069
PNG
(CHEMBL1824037)
Show SMILES [O-][N+](=O)c1ccc2OCC(=O)N(CCN3CCC(CC3)NCc3ccc4OCC(=O)Nc4n3)c2c1
Show InChI InChI=1S/C23H26N6O6/c30-21-13-34-20-3-1-16(25-23(20)26-21)12-24-15-5-7-27(8-6-15)9-10-28-18-11-17(29(32)33)2-4-19(18)35-14-22(28)31/h1-4,11,15,24H,5-10,12-14H2,(H,25,26,30)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 2.43E+4n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of human ERG by electrophysiological assay


Bioorg Med Chem Lett 21: 5432-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.126
BindingDB Entry DOI: 10.7270/Q2JM2B0P
More data for this
Ligand-Target Pair