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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cysteinyl leukotriene receptor 1' and Ligand = 'BDBM50280698'   
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)
BDBM50280698
PNG
(CHEMBL274049 | Sodium; 3-[1-[3-(7-chloro-quinolin-...)
Show SMILES CS(=O)(=O)Nc1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C29H29ClN2O5S2/c1-39(35,36)32-26-8-3-2-5-20(26)11-14-28(38-16-15-29(33)34)22-6-4-7-25(17-22)37-19-24-13-10-21-9-12-23(30)18-27(21)31-24/h2-10,12-13,17-18,28,32H,11,14-16,19H2,1H3,(H,33,34)/p-1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 0.560n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 1


Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor 1


(GUINEA PIG)
BDBM50280698
PNG
(CHEMBL274049 | Sodium; 3-[1-[3-(7-chloro-quinolin-...)
Show SMILES CS(=O)(=O)Nc1ccccc1CCC(SCCC([O-])=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1
Show InChI InChI=1S/C29H29ClN2O5S2/c1-39(35,36)32-26-8-3-2-5-20(26)11-14-28(38-16-15-29(33)34)22-6-4-7-25(17-22)37-19-24-13-10-21-9-12-23(30)18-27(21)31-24/h2-10,12-13,17-18,28,32H,11,14-16,19H2,1H3,(H,33,34)/p-1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 0.600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-Leukotriene D4 binding to guinea-pig lung membranes was determined; experiment 2


Bioorg Med Chem Lett 2: 1141-1146 (1992)


Article DOI: 10.1016/S0960-894X(00)80635-6
BindingDB Entry DOI: 10.7270/Q2D21XJR
More data for this
Ligand-Target Pair