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SMILES: C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1ncc(Cc2ccccc2)[nH]1)c1ccccc1

InChI Key: InChIKey=FECPGTWXDAVBIN-PIIWDFAUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009589   
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
Mineralocorticoid receptor


(Homo sapiens (Human))		BDBM50009589
PNG
(CHEMBL3234849)
Show SMILES C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1ncc(Cc2ccccc2)[nH]1)c1ccccc1 |r|
Show InChI InChI=1S/C28H25N3O3/c1-20(23-15-9-4-10-16-23)31-26(32)28(34-27(31)33,18-22-13-7-3-8-14-22)25-29-19-24(30-25)17-21-11-5-2-6-12-21/h2-16,19-20H,17-18H2,1H3,(H,29,30)/t20-,28-/m1/s1
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Article
PubMed
n/an/a 270n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at mineralocorticoid receptor (unknown origin) by PathHunter assay

Bioorg Med Chem Lett 24: 1681-4 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.057
BindingDB Entry DOI: 10.7270/Q2N87C9H
More data for this
Ligand-Target Pair