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BDBM50214376 3,6-dihydroxy-N-(6-{[2-(4-methanesulfonamidophenoxy)ethyl][2-(4-methanesulfonamidophenyl)ethyl]amino}hexyl)-3'-oxo-3'H,10H-spiro[anthracene-9,1'-[2]benzofuran]-5'-carboxamide::CHEMBL375516

SMILES: CS(=O)(=O)Nc1ccc(CCN(CCCCCCNC(=O)c2ccc3c(c2)C(=O)OC32c3ccc(O)cc3Cc3cc(O)ccc23)CCOc2ccc(NS(C)(=O)=O)cc2)cc1

InChI Key: InChIKey=VHDCYPQVFTWGCR-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50214376   
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))
BDBM50214376
PNG
(3,6-dihydroxy-N-(6-{[2-(4-methanesulfonamidophenox...)
Show SMILES CS(=O)(=O)Nc1ccc(CCN(CCCCCCNC(=O)c2ccc3c(c2)C(=O)OC32c3ccc(O)cc3Cc3cc(O)ccc23)CCOc2ccc(NS(C)(=O)=O)cc2)cc1
Show InChI InChI=1S/C46H50N4O10S2/c1-61(55,56)48-35-10-7-31(8-11-35)21-24-50(25-26-59-39-16-12-36(13-17-39)49-62(2,57)58)23-6-4-3-5-22-47-44(53)32-9-18-43-40(30-32)45(54)60-46(43)41-19-14-37(51)28-33(41)27-34-29-38(52)15-20-42(34)46/h7-20,28-30,48-49,51-52H,3-6,21-27H2,1-2H3,(H,47,53)
PDB
MMDB

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PC cid
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Article
PubMed
15n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from hERG expressed in HEK293 cells by SPA


J Med Chem 50: 2931-41 (2007)


Article DOI: 10.1021/jm0700565
BindingDB Entry DOI: 10.7270/Q2736RR2
More data for this
Ligand-Target Pair