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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Leukotriene B4 receptor' and Ligand = 'BDBM50001648'   
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


(Homo sapiens (Human))
BDBM50001648
PNG
(6-[4-(4-Dimethylamino-phenyl)-6-phenyl-pyridin-2-y...)
Show SMILES CN(C)c1ccc(cc1)-c1cc(OCCCCCC(O)=O)nc(c1)-c1ccccc1
Show InChI InChI=1S/C25H28N2O3/c1-27(2)22-14-12-19(13-15-22)21-17-23(20-9-5-3-6-10-20)26-24(18-21)30-16-8-4-7-11-25(28)29/h3,5-6,9-10,12-15,17-18H,4,7-8,11,16H2,1-2H3,(H,28,29)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 30n/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)


Article DOI: 10.1021/jm00101a008
BindingDB Entry DOI: 10.7270/Q2QR4W2W
More data for this
Ligand-Target Pair
Leukotriene B4 receptor


(Homo sapiens (Human))
BDBM50001648
PNG
(6-[4-(4-Dimethylamino-phenyl)-6-phenyl-pyridin-2-y...)
Show SMILES CN(C)c1ccc(cc1)-c1cc(OCCCCCC(O)=O)nc(c1)-c1ccccc1
Show InChI InChI=1S/C25H28N2O3/c1-27(2)22-14-12-19(13-15-22)21-17-23(20-9-5-3-6-10-20)26-24(18-21)30-16-8-4-7-11-25(28)29/h3,5-6,9-10,12-15,17-18H,4,7-8,11,16H2,1-2H3,(H,28,29)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 110n/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)


Article DOI: 10.1021/jm00101a008
BindingDB Entry DOI: 10.7270/Q2QR4W2W
More data for this
Ligand-Target Pair