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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mineralocorticoid receptor' and Ligand = 'BDBM50510667'   
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
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50510667
PNG
(CHEMBL4515343)
Show SMILES CCC(CO)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cc(Br)cc12
Show InChI InChI=1S/C19H20BrClN2O3S/c1-3-19(12-24,13-4-6-15(21)7-5-13)23-9-8-16-17(22-27(2,25)26)10-14(20)11-18(16)23/h4-11,22,24H,3,12H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 567n/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Antagonist activity at mineralocorticoid receptor (unknown origin)


Bioorg Med Chem Lett 29: 1854-1858 (2019)


Article DOI: 10.1016/j.bmcl.2019.04.024
BindingDB Entry DOI: 10.7270/Q2668HHH
More data for this
Ligand-Target Pair