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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mineralocorticoid receptor' and Ligand = 'BDBM50103247'   
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))
BDBM50103247
PNG
(10-Methoxy-2,2,4-trimethyl-5-(3-trifluoromethyl-ph...)
Show SMILES COc1cccc2OC(c3cccc(c3)C(F)(F)F)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:29|
Show InChI InChI=1S/C27H24F3NO2/c1-15-14-26(2,3)31-19-12-11-18-23-20(32-4)9-6-10-21(23)33-25(24(18)22(15)19)16-7-5-8-17(13-16)27(28,29)30/h5-14,25,31H,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
493n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for mineralocorticoid receptor


J Med Chem 44: 2879-85 (2001)


BindingDB Entry DOI: 10.7270/Q2ZG6RJP
More data for this
Ligand-Target Pair