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BDBM18742 4-{1-[2-(2-chlorophenyl)ethoxy]ethyl}-6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinoline::dihydroquinoline-based ligand, 31

SMILES: COc1ccccc1-c1ccc2NC(C)(C)C=C(C(C)OCCc3ccccc3Cl)c2c1

InChI Key: InChIKey=LEVDGZJDDWYGIQ-UHFFFAOYSA-N

Data: 2 IC50

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 = 18742   
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))
BDBM18742
PNG
(4-{1-[2-(2-chlorophenyl)ethoxy]ethyl}-6-(2-methoxy...)
Show SMILES COc1ccccc1-c1ccc2NC(C)(C)C=C(C(C)OCCc3ccccc3Cl)c2c1 |t:17|
Show InChI InChI=1S/C28H30ClNO2/c1-19(32-16-15-20-9-5-7-11-25(20)29)24-18-28(2,3)30-26-14-13-21(17-23(24)26)22-10-6-8-12-27(22)31-4/h5-14,17-19,30H,15-16H2,1-4H3
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 17: 5091-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.021
BindingDB Entry DOI: 10.7270/Q21J981M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM18742
PNG
(4-{1-[2-(2-chlorophenyl)ethoxy]ethyl}-6-(2-methoxy...)
Show SMILES COc1ccccc1-c1ccc2NC(C)(C)C=C(C(C)OCCc3ccccc3Cl)c2c1 |t:17|
Show InChI InChI=1S/C28H30ClNO2/c1-19(32-16-15-20-9-5-7-11-25(20)29)24-18-28(2,3)30-26-14-13-21(17-23(24)26)22-10-6-8-12-27(22)31-4/h5-14,17-19,30H,15-16H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Patents


Similars

Article
PubMed
n/an/a 290n/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 17: 5091-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.021
BindingDB Entry DOI: 10.7270/Q21J981M
More data for this
Ligand-Target Pair