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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mineralocorticoid receptor' and Ligand = 'BDBM50235952'   
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


(RAT)		BDBM50235952
PNG
(CHEMBL4079872)
Show SMILES CCOCc1cc(NC(=O)c2ccc(c(OC)c2)S(N)(=O)=O)ccc1-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C24H23F3N2O5S/c1-3-34-14-16-12-17(9-10-18(16)19-6-4-5-7-20(19)24(25,26)27)29-23(30)15-8-11-22(35(28,31)32)21(13-15)33-2/h4-13H,3,14H2,1-2H3,(H,29,30)(H2,28,31,32)
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Instituto de Qu£mica M£dica (IQM-CSIC)

Curated by ChEMBL


Assay Description
Displacement of [3H]-Aldosterone from MR in rat renal soluble fraction measured after 18 hrs in presence of glucocorticoid receptor antagonist RU-486...

J Med Chem 60: 2629-2650 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01065
BindingDB Entry DOI: 10.7270/Q2HD7XXB
More data for this
Ligand-Target Pair