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SMILES: COc1ccccc1-c1ccc2NC(C)(C)C=C(CSc3ccc(Cl)cc3)c2c1

InChI Key: InChIKey=DKLYGWOPRPJURQ-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 2 hits for monomerid = 18714   
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
Progesterone receptor


(Homo sapiens (Human))
BDBM18714
PNG
(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-(2-methoxyp...)
Show SMILES COc1ccccc1-c1ccc2NC(C)(C)C=C(CSc3ccc(Cl)cc3)c2c1 |t:17|
Show InChI InChI=1S/C25H24ClNOS/c1-25(2)15-18(16-29-20-11-9-19(26)10-12-20)22-14-17(8-13-23(22)27-25)21-6-4-5-7-24(21)28-3/h4-15,27H,16H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

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



Boehringer Ingelheim Pharmaceuticals Inc.



Assay Description
IC50 values shown are means of a single experiment done in duplicate 11-point concentration-effect curves.


Bioorg Med Chem Lett 16: 1549-52 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.043
BindingDB Entry DOI: 10.7270/Q25B00RG
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM18714
PNG
(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-(2-methoxyp...)
Show SMILES COc1ccccc1-c1ccc2NC(C)(C)C=C(CSc3ccc(Cl)cc3)c2c1 |t:17|
Show InChI InChI=1S/C25H24ClNOS/c1-25(2)15-18(16-29-20-11-9-19(26)10-12-20)22-14-17(8-13-23(22)27-25)21-6-4-5-7-24(21)28-3/h4-15,27H,16H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 800n/an/an/an/a7.422



Boehringer Ingelheim Pharmaceuticals Inc.



Assay Description
IC50 values shown are means of a single experiment done in duplicate 11-point concentration-effect curves.


Bioorg Med Chem Lett 16: 1549-52 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.043
BindingDB Entry DOI: 10.7270/Q25B00RG
More data for this
Ligand-Target Pair