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SMILES: CCC(Cc1cccc(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C

InChI Key: InChIKey=GWBHDCFCUBNVKR-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 = 50444407   
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))
BDBM50444407
PNG
(CHEMBL3094473)
Show SMILES CCC(Cc1cccc(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C21H29NO2S/c1-7-20(13-19-10-8-9-15(3)18(19)6)22-25(23,24)21-16(4)11-14(2)12-17(21)5/h8-12,20,22H,7,13H2,1-6H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of glucocorticoid receptor (unknown origin) expressed in baculovirus-infected insect cells by fluorescence polarization assay


Bioorg Med Chem Lett 23: 6645-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.047
BindingDB Entry DOI: 10.7270/Q2VQ345N
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50444407
PNG
(CHEMBL3094473)
Show SMILES CCC(Cc1cccc(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C21H29NO2S/c1-7-20(13-19-10-8-9-15(3)18(19)6)22-25(23,24)21-16(4)11-14(2)12-17(21)5/h8-12,20,22H,7,13H2,1-6H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of progesterone receptor (unknown origin) expressed in baculovirus-infected insect cells by fluorescence polarization assay


Bioorg Med Chem Lett 23: 6645-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.047
BindingDB Entry DOI: 10.7270/Q2VQ345N
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50444407
PNG
(CHEMBL3094473)
Show SMILES CCC(Cc1cccc(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C21H29NO2S/c1-7-20(13-19-10-8-9-15(3)18(19)6)22-25(23,24)21-16(4)11-14(2)12-17(21)5/h8-12,20,22H,7,13H2,1-6H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of mineralocorticoid receptor (unknown origin) expressed in baculovirus-infected insect cells by fluorescence polarization assay


Bioorg Med Chem Lett 23: 6645-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.047
BindingDB Entry DOI: 10.7270/Q2VQ345N
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50444407
PNG
(CHEMBL3094473)
Show SMILES CCC(Cc1cccc(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C21H29NO2S/c1-7-20(13-19-10-8-9-15(3)18(19)6)22-25(23,24)21-16(4)11-14(2)12-17(21)5/h8-12,20,22H,7,13H2,1-6H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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 human foreskin fibroblasts assessed as IL-1-mediated IL-6 synthesis after 24 hrs


Bioorg Med Chem Lett 23: 6645-9 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.047
BindingDB Entry DOI: 10.7270/Q2VQ345N
More data for this
Ligand-Target Pair