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BDBM50009636 CHEMBL3234862

SMILES: C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(CC2CC2)o1)c1ccccc1

InChI Key: InChIKey=KNZGTCDSRPFFDS-VOIUYBSRSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009636   
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))
BDBM50009636
PNG
(CHEMBL3234862)
Show SMILES C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(CC2CC2)o1)c1ccccc1 |r|
Show InChI InChI=1S/C24H23N3O4/c1-16(19-10-6-3-7-11-19)27-22(28)24(31-23(27)29,15-18-8-4-2-5-9-18)21-26-25-20(30-21)14-17-12-13-17/h2-11,16-17H,12-15H2,1H3/t16-,24-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 470n/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