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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 514.5
BDBM50084784

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)
BDBM50084784
PNG
(2-[6-(Quinolin-2-ylmethoxy)-naphthalen-2-yl]-N-[2-...)
Show SMILES CC(C(=O)NCc1ccccc1-c1nnn[nH]1)c1ccc2cc(OCc3ccc4ccccc4n3)ccc2c1
Show InChI InChI=1S/C31H26N6O2/c1-20(31(38)32-18-25-7-2-4-8-28(25)30-34-36-37-35-30)22-10-11-24-17-27(15-13-23(24)16-22)39-19-26-14-12-21-6-3-5-9-29(21)33-26/h2-17,20H,18-19H2,1H3,(H,32,38)(H,34,35,36,37)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents


Similars

PubMed
12n/an/an/an/an/an/an/an/a



Laboratorios Menarini

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Cysteinyl leukotriene D4 receptor by using [3H]-LTD4 binding assay in guinea pig lung membranes


J Med Chem 43: 392-400 (2000)


BindingDB Entry DOI: 10.7270/Q2DJ5DVX
More data for this
Ligand-Target Pair