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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Potassium voltage-gated channel subfamily H member 2' and Ligand = 'BDBM50539050'   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50539050
PNG
(CHEMBL4634170)
Show SMILES COc1cc(cc(OC(C)C)n1)[C@](O)(CCN(C)C)[C@H](c1cccc(OC)c1F)c1cc2cc(Br)ccc2nc1OC |r|
Show InChI InChI=1S/C32H37BrFN3O5/c1-19(2)42-28-18-21(17-27(36-28)40-6)32(38,13-14-37(3)4)29(23-9-8-10-26(39-5)30(23)34)24-16-20-15-22(33)11-12-25(20)35-31(24)41-7/h8-12,15-19,29,38H,13-14H2,1-7H3/t29-,32-/m1/s1
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PC cid
PC sid
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Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human ERG


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2019.115213
BindingDB Entry DOI: 10.7270/Q24X5CB3
More data for this
Ligand-Target Pair