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SMILES: Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(COc1ccccc1)C(F)(F)F

InChI Key: InChIKey=IFNZOVIDIOXFMG-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50444199   
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
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50444199
PNG
(CHEMBL3093459)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(COc1ccccc1)C(F)(F)F
Show InChI InChI=1S/C18H20F3NO3S/c1-12-9-13(2)17(14(3)10-12)26(23,24)22-16(18(19,20)21)11-25-15-7-5-4-6-8-15/h4-10,16,22H,11H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonist activity at glucocorticoid receptor in HFF assessed as inhibition of IL-1-induced IL-6 production after 24 hrs


Bioorg Med Chem Lett 23: 6640-4 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.052
BindingDB Entry DOI: 10.7270/Q2DN46G5
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50444199
PNG
(CHEMBL3093459)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(COc1ccccc1)C(F)(F)F
Show InChI InChI=1S/C18H20F3NO3S/c1-12-9-13(2)17(14(3)10-12)26(23,24)22-16(18(19,20)21)11-25-15-7-5-4-6-8-15/h4-10,16,22H,11H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 210n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Displacement of TAMRA-labeled dexamethasone from glucocorticoid receptor (unknown origin) by fluorescence polarization competitive binding assay


Bioorg Med Chem Lett 23: 6640-4 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.052
BindingDB Entry DOI: 10.7270/Q2DN46G5
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50444199
PNG
(CHEMBL3093459)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(COc1ccccc1)C(F)(F)F
Show InChI InChI=1S/C18H20F3NO3S/c1-12-9-13(2)17(14(3)10-12)26(23,24)22-16(18(19,20)21)11-25-15-7-5-4-6-8-15/h4-10,16,22H,11H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 340n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Binding affinity to mineralocorticoid receptor (unknown origin) by fluorescence polarization competitive binding assay


Bioorg Med Chem Lett 23: 6640-4 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.052
BindingDB Entry DOI: 10.7270/Q2DN46G5
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50444199
PNG
(CHEMBL3093459)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(COc1ccccc1)C(F)(F)F
Show InChI InChI=1S/C18H20F3NO3S/c1-12-9-13(2)17(14(3)10-12)26(23,24)22-16(18(19,20)21)11-25-15-7-5-4-6-8-15/h4-10,16,22H,11H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Displacement of TAMRA-labeled mifepristone from progesterone receptor (unknown origin) by fluorescence polarization competitive binding assay


Bioorg Med Chem Lett 23: 6640-4 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.052
BindingDB Entry DOI: 10.7270/Q2DN46G5
More data for this
Ligand-Target Pair