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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 556.4
BDBM50296104

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cysteinyl leukotriene receptor 1


(GUINEA PIG)
BDBM50296104
PNG
(3-(5-(3-(2-(6,7-dichloroquinolin-2-yl)vinyl)benzyl...)
Show SMILES OC(=O)CCN1CCc2c(C1)c1ccccc1n2Cc1cccc(\C=C\c2ccc3cc(Cl)c(Cl)cc3n2)c1
Show InChI InChI=1S/C32H27Cl2N3O2/c33-27-17-23-9-11-24(35-29(23)18-28(27)34)10-8-21-4-3-5-22(16-21)19-37-30-7-2-1-6-25(30)26-20-36(14-12-31(26)37)15-13-32(38)39/h1-11,16-18H,12-15,19-20H2,(H,38,39)/b10-8+
PDB

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 21n/an/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane


Bioorg Med Chem Lett 19: 4299-302 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1
More data for this
Ligand-Target Pair