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BDBM50306021 2-isopropyl-3-(3-(3-(methylsulfonylmethyl)phenoxy)phenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine::CHEMBL604797

SMILES: CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(CS(C)(=O)=O)c2)c1)C(F)(F)F

InChI Key: InChIKey=ZEAJIAJGUMPEMM-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50306021   
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
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50306021
PNG
(2-isopropyl-3-(3-(3-(methylsulfonylmethyl)phenoxy)...)
Show SMILES CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(CS(C)(=O)=O)c2)c1)C(F)(F)F
Show InChI InChI=1S/C25H23F3N2O3S/c1-16(2)22-23(30-12-6-11-21(24(30)29-22)25(26,27)28)18-8-5-10-20(14-18)33-19-9-4-7-17(13-19)15-34(3,31)32/h4-14,16H,15H2,1-3H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 187n/an/an/an/an/an/a



Wyeth Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]T0901317 from human recombinant LXRalpha LBD


Bioorg Med Chem Lett 20: 521-5 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.098
BindingDB Entry DOI: 10.7270/Q27D2W3S
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50306021
PNG
(2-isopropyl-3-(3-(3-(methylsulfonylmethyl)phenoxy)...)
Show SMILES CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(CS(C)(=O)=O)c2)c1)C(F)(F)F
Show InChI InChI=1S/C25H23F3N2O3S/c1-16(2)22-23(30-12-6-11-21(24(30)29-22)25(26,27)28)18-8-5-10-20(14-18)33-19-9-4-7-17(13-19)15-34(3,31)32/h4-14,16H,15H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Wyeth Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]T0901317 from human recombinant LXRbeta LBD


Bioorg Med Chem Lett 20: 521-5 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.098
BindingDB Entry DOI: 10.7270/Q27D2W3S
More data for this
Ligand-Target Pair