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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 629.8
BDBM50284906

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)
BDBM50284906
PNG
(CHEMBL40686 | [1-((R)-3-[2-(1-Hydroxy-1-methyl-eth...)
Show SMILES CC(C)(O)c1ccccc1CC[C@@H](SCC1(CC(O)=O)CC1)c1cccc(\C=C\c2nc(CSc3ccccc3)cs2)c1
Show InChI InChI=1S/C36H39NO3S3/c1-35(2,40)31-14-7-6-10-27(31)16-17-32(43-25-36(19-20-36)22-34(38)39)28-11-8-9-26(21-28)15-18-33-37-29(24-42-33)23-41-30-12-4-3-5-13-30/h3-15,18,21,24,32,40H,16-17,19-20,22-23,25H2,1-2H3,(H,38,39)/b18-15+/t32-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 42n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-LTD4 binding on guinea-pig lung membranes


Bioorg Med Chem Lett 5: 1615-1620 (1995)


Article DOI: 10.1016/0960-894X(95)00265-U
BindingDB Entry DOI: 10.7270/Q2NV9J6V
More data for this
Ligand-Target Pair