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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Leukotriene B4 receptor 1' and Ligand = 'BDBM50001659'   
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
Leukotriene B4 receptor 1


(Homo sapiens (Human))
BDBM50001659
PNG
(6-[6-Phenyl-4-(4-trifluoromethyl-phenyl)-pyridin-2...)
Show SMILES OC(=O)CCCCCOc1cc(cc(n1)-c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C24H22F3NO3/c25-24(26,27)20-12-10-17(11-13-20)19-15-21(18-7-3-1-4-8-18)28-22(16-19)31-14-6-2-5-9-23(29)30/h1,3-4,7-8,10-13,15-16H,2,5-6,9,14H2,(H,29,30)
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PubMed
n/an/a 10n/an/an/an/an/an/a



Centre de Recherche de Vitry-Alfortville

Curated by ChEMBL


Assay Description
Inhibition of [3H]-LTB4 binding to Leukotriene B4 receptor in the guinea pig spleen membranes.


J Med Chem 35: 4315-24 (1992)


BindingDB Entry DOI: 10.7270/Q2QR4W2W
More data for this
Ligand-Target Pair
Leukotriene B4 receptor 1


(Homo sapiens (Human))
BDBM50001659
PNG
(6-[6-Phenyl-4-(4-trifluoromethyl-phenyl)-pyridin-2...)
Show SMILES OC(=O)CCCCCOc1cc(cc(n1)-c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C24H22F3NO3/c25-24(26,27)20-12-10-17(11-13-20)19-15-21(18-7-3-1-4-8-18)28-22(16-19)31-14-6-2-5-9-23(29)30/h1,3-4,7-8,10-13,15-16H,2,5-6,9,14H2,(H,29,30)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


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PubMed
n/an/a 150n/an/an/an/an/an/a



Centre de Recherche de Vitry-Alfortville

Curated by ChEMBL


Assay Description
Inhibition of [3H]-LTB4 binding to Leukotriene B4 receptor in the human polymorphonuclear leukocytes.


J Med Chem 35: 4315-24 (1992)


BindingDB Entry DOI: 10.7270/Q2QR4W2W
More data for this
Ligand-Target Pair
Leukotriene B4 receptor 1


(Homo sapiens (Human))
BDBM50001659
PNG
(6-[6-Phenyl-4-(4-trifluoromethyl-phenyl)-pyridin-2...)
Show SMILES OC(=O)CCCCCOc1cc(cc(n1)-c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C24H22F3NO3/c25-24(26,27)20-12-10-17(11-13-20)19-15-21(18-7-3-1-4-8-18)28-22(16-19)31-14-6-2-5-9-23(29)30/h1,3-4,7-8,10-13,15-16H,2,5-6,9,14H2,(H,29,30)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Centre de Recherche de Vitry-Alfortville

Curated by ChEMBL


Assay Description
Inhibition of LTB4-induced elastase release in human polymorphonuclear leukocytes


J Med Chem 35: 4315-24 (1992)


BindingDB Entry DOI: 10.7270/Q2QR4W2W
More data for this
Ligand-Target Pair