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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 406.4
BDBM50015520

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)
BDBM50015520
PNG
(4-[6-(2-Cyclopentyl-acetylamino)-indol-1-ylmethyl]...)
Show SMILES COc1cc(ccc1Cn1ccc2ccc(NC(=O)CC3CCCC3)cc12)C(O)=O
Show InChI InChI=1S/C24H26N2O4/c1-30-22-13-18(24(28)29)6-7-19(22)15-26-11-10-17-8-9-20(14-21(17)26)25-23(27)12-16-4-2-3-5-16/h6-11,13-14,16H,2-5,12,15H2,1H3,(H,25,27)(H,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
200n/an/an/an/an/an/an/an/a



ICI Pharmaceuticals Group

Curated by ChEMBL


Assay Description
Displacement of [3H]-LTD4 on guinea pig lung parenchymal membranes


J Med Chem 33: 1781-90 (1990)


BindingDB Entry DOI: 10.7270/Q2862FDP
More data for this
Ligand-Target Pair