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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glucocorticoid receptor' and Ligand = 'BDBM50144152'   
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
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50144152
PNG
(4-(8-Methanesulfonylamino-1-methoxy-6H-benzo[c]chr...)
Show SMILES CCOC(=O)c1ccc(cc1)C1Oc2cccc(OC)c2-c2ccc(NS(C)(=O)=O)cc12
Show InChI InChI=1S/C24H23NO6S/c1-4-30-24(26)16-10-8-15(9-11-16)23-19-14-17(25-32(3,27)28)12-13-18(19)22-20(29-2)6-5-7-21(22)31-23/h5-14,23,25H,4H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 61n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]dexamethasone from human Glucocorticoid receptor (GR); Value ranges from 133-161 nM


Bioorg Med Chem Lett 14: 2079-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.048
BindingDB Entry DOI: 10.7270/Q21V5FHJ
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50144152
PNG
(4-(8-Methanesulfonylamino-1-methoxy-6H-benzo[c]chr...)
Show SMILES CCOC(=O)c1ccc(cc1)C1Oc2cccc(OC)c2-c2ccc(NS(C)(=O)=O)cc12
Show InChI InChI=1S/C24H23NO6S/c1-4-30-24(26)16-10-8-15(9-11-16)23-19-14-17(25-32(3,27)28)12-13-18(19)22-20(29-2)6-5-7-21(22)31-23/h5-14,23,25H,4H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 388n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Effect on human Glucocorticoid receptor (GR) in a whole cell assay to measure functional cellular GR-antagonism (GRAF)


Bioorg Med Chem Lett 14: 2079-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.048
BindingDB Entry DOI: 10.7270/Q21V5FHJ
More data for this
Ligand-Target Pair