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BDBM50001616 6-[4-(4-Amino-phenyl)-quinolin-2-yloxy]-2,2-dimethyl-hexanoic acid::CHEMBL134697

SMILES: CC(C)(CCCCOc1cc(-c2ccc(N)cc2)c2ccccc2n1)C(O)=O

InChI Key: InChIKey=CCAHDZNXPZTVOL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50001616   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Leukotriene B4 receptor


(HUMAN)
BDBM50001616
PNG
(6-[4-(4-Amino-phenyl)-quinolin-2-yloxy]-2,2-dimeth...)
Show SMILES CC(C)(CCCCOc1cc(-c2ccc(N)cc2)c2ccccc2n1)C(O)=O
Show InChI InChI=1S/C23H26N2O3/c1-23(2,22(26)27)13-5-6-14-28-21-15-19(16-9-11-17(24)12-10-16)18-7-3-4-8-20(18)25-21/h3-4,7-12,15H,5-6,13-14,24H2,1-2H3,(H,26,27)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 250n/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: 4306-14 (1992)


Article DOI: 10.1021/jm00101a007
BindingDB Entry DOI: 10.7270/Q2VH5MS6
More data for this
Ligand-Target Pair
LTB4R


(HUMAN)
BDBM50001616
PNG
(6-[4-(4-Amino-phenyl)-quinolin-2-yloxy]-2,2-dimeth...)
Show SMILES CC(C)(CCCCOc1cc(-c2ccc(N)cc2)c2ccccc2n1)C(O)=O
Show InChI InChI=1S/C23H26N2O3/c1-23(2,22(26)27)13-5-6-14-28-21-15-19(16-9-11-17(24)12-10-16)18-7-3-4-8-20(18)25-21/h3-4,7-12,15H,5-6,13-14,24H2,1-2H3,(H,26,27)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 40n/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: 4306-14 (1992)


Article DOI: 10.1021/jm00101a007
BindingDB Entry DOI: 10.7270/Q2VH5MS6
More data for this
Ligand-Target Pair