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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 505.3
BDBM50064070

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)
BDBM50064070
PNG
(6-Bromo-2-[3-(1-methyl-1H-benzoimidazol-2-ylmethox...)
Show SMILES Cn1c(COc2cccc(c2)-c2cc(=O)c3cc(Br)cc(C(O)=O)c3o2)nc2ccccc12
Show InChI InChI=1S/C25H17BrN2O5/c1-28-20-8-3-2-7-19(20)27-23(28)13-32-16-6-4-5-14(9-16)22-12-21(29)17-10-15(26)11-18(25(30)31)24(17)33-22/h2-12H,13H2,1H3,(H,30,31)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/a 210n/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
In vitro affinity for CysLT1 receptors on guinea pig lung membranes, measured by displacement of [3H]-LTD4.


J Med Chem 41: 1428-38 (1998)


Article DOI: 10.1021/jm970179x
BindingDB Entry DOI: 10.7270/Q21835MZ
More data for this
Ligand-Target Pair