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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 502.5
BDBM50084802

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)
BDBM50084802
PNG
(4-(2-{[7-(5-Phenyl-pyridin-2-ylmethoxy)-naphthalen...)
Show SMILES OC(=O)c1ccc(CCNC(=O)c2ccc3ccc(OCc4ccc(cn4)-c4ccccc4)cc3c2)cc1
Show InChI InChI=1S/C32H26N2O4/c35-31(33-17-16-22-6-8-25(9-7-22)32(36)37)26-11-10-24-13-15-30(19-28(24)18-26)38-21-29-14-12-27(20-34-29)23-4-2-1-3-5-23/h1-15,18-20H,16-17,21H2,(H,33,35)(H,36,37)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
79n/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