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BDBM50390734 CHEMBL2070357

SMILES: CC(C)CN(c1ccc(cc1)C(O)(C#CC(C)(C)C)C(F)(F)F)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=QZQJBNAIIAODJP-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50390734   
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
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM50390734
PNG
(CHEMBL2070357)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CC(C)(C)C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H28F3NO3S/c1-18(2)17-28(32(30,31)21-9-7-6-8-10-21)20-13-11-19(12-14-20)23(29,24(25,26)27)16-15-22(3,4)5/h6-14,18,29H,17H2,1-5H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-methylbenzenesulfonamide from GST-tagged LXRbeta ligand binding domai...


Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM50390734
PNG
(CHEMBL2070357)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)(C#CC(C)(C)C)C(F)(F)F)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H28F3NO3S/c1-18(2)17-28(32(30,31)21-9-7-6-8-10-21)20-13-11-19(12-14-20)23(29,24(25,26)27)16-15-22(3,4)5/h6-14,18,29H,17H2,1-5H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LXRbeta ligand binding domain expressed in HEK293 cells coexpressing GAL4 assessed as decrease in [3H]N-(4-(1,1,1,3,3,3-hexafl...


Bioorg Med Chem Lett 22: 5966-70 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.048
BindingDB Entry DOI: 10.7270/Q2PR7X24
More data for this
Ligand-Target Pair