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BDBM50316090 5-Methoxy-3-methyl-2-[3'-(methylsulfonyl)biphenyl-4-yl]quinoxaline::CHEMBL1093916

SMILES: COc1cccc2nc(c(C)nc12)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O

InChI Key: InChIKey=SJSGAVBPKLPYMR-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50316090   
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))
BDBM50316090
PNG
(5-Methoxy-3-methyl-2-[3'-(methylsulfonyl)biphenyl-...)
Show SMILES COc1cccc2nc(c(C)nc12)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
Show InChI InChI=1S/C23H20N2O3S/c1-15-22(25-20-8-5-9-21(28-2)23(20)24-15)17-12-10-16(11-13-17)18-6-4-7-19(14-18)29(3,26)27/h4-14H,1-3H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

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 LXRalpha ligand binding domain


J Med Chem 53: 3296-304 (2010)


Article DOI: 10.1021/jm100034x
BindingDB Entry DOI: 10.7270/Q29W0FN8
More data for this
Ligand-Target Pair
Liver X receptor (LXR alpha AND LXR beta)


(Homo sapiens (Human))
BDBM50316090
PNG
(5-Methoxy-3-methyl-2-[3'-(methylsulfonyl)biphenyl-...)
Show SMILES COc1cccc2nc(c(C)nc12)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
Show InChI InChI=1S/C23H20N2O3S/c1-15-22(25-20-8-5-9-21(28-2)23(20)24-15)17-12-10-16(11-13-17)18-6-4-7-19(14-18)29(3,26)27/h4-14H,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 395n/an/an/an/an/an/a



Wyeth Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]T0901317 from human LXRbeta ligand binding domain


J Med Chem 53: 3296-304 (2010)


Article DOI: 10.1021/jm100034x
BindingDB Entry DOI: 10.7270/Q29W0FN8
More data for this
Ligand-Target Pair