BDBM58922 MLS001304727::MONTELUKAST Na::SMR000469188::cid_23663996::sodium;2-[1-[[(1R)-1-[3-[(E)-2-(7-chloranylquinolin-2-yl)ethenyl]phenyl]-3-[2-(2-oxidanylpropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]ethanoate::sodium;2-[1-[[(1R)-1-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetate::sodium;2-[1-[[[(1R)-1-[3-[(E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]thio]methyl]cyclopropyl]acetate::sodium;2-[1-[[[(1R)-1-[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]propyl]thio]methyl]cyclopropyl]acetate

SMILES CC(C)(O)c1ccccc1CC[C@@H](SCC1(CC([O-])=O)CC1)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1

InChI Key InChIKey=UCHDWCPVSPXUMX-TZIWLTJVSA-M

Data  2 KI  3 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 58922   

TargetCytochrome P450 2C9(Homo sapiens (Human))
University of Helsinki

Curated by ChEMBL
LigandPNGBDBM58922(MLS001304727 | MONTELUKAST Na | SMR000469188 | cid...)
Affinity DataKi:  7.40E+3nMAssay Description:Inhibition of recombinant human CYP2C9 expressed in microsomes isolated from baculovirus infected insect cell after 10 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C8(Homo sapiens (Human))
University of Helsinki

Curated by ChEMBL
LigandPNGBDBM58922(MLS001304727 | MONTELUKAST Na | SMR000469188 | cid...)
Affinity DataKi:  1.10E+4nMAssay Description:Inhibition of recombinant human CYP2C8 expressed in microsomes isolated from baculovirus infected insect cell after 3 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProbable nicotinate-nucleotide adenylyltransferase(Staphylococcus aureus subsp. aureus N315)
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM58922(MLS001304727 | MONTELUKAST Na | SMR000469188 | cid...)
Affinity DataIC50:  2.06E+4nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCysteinyl leukotriene receptor 2(Homo sapiens (Human))
Shanghai Institute of Materia Medica

Curated by ChEMBL
LigandPNGBDBM58922(MLS001304727 | MONTELUKAST Na | SMR000469188 | cid...)
Affinity DataIC50:  2.70E+4nMAssay Description:Antagonist activity against CysLT2 receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of LTD4-induced calcium mobilization pr...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCysteinyl leukotriene receptor 1(Homo sapiens (Human))
Shanghai Institute of Materia Medica

Curated by ChEMBL
LigandPNGBDBM58922(MLS001304727 | MONTELUKAST Na | SMR000469188 | cid...)
Affinity DataIC50:  310nMAssay Description:Antagonist activity against CysLT1 receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of LTD4-induced calcium mobilization pr...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetStreptokinase A(Streptococcus pyogenes M1 GAS)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM58922(MLS001304727 | MONTELUKAST Na | SMR000469188 | cid...)
Affinity DataEC50:  3.41E+3nMAssay Description:Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay