BindingDB logo
myBDB logout

BDBM50013517 2-{3-[4-(1H-Tetrazol-5-yl)-butoxy]-phenoxymethyl}-quinoline::CHEMBL18558

SMILES: C(CCc1nnn[nH]1)COc1cccc(OCc2ccc3ccccc3n2)c1

InChI Key: InChIKey=JRLYDKCKUUVXLK-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50013517   
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
Cysteinyl leukotriene receptor 1


(GUINEA PIG)
BDBM50013517
PNG
(2-{3-[4-(1H-Tetrazol-5-yl)-butoxy]-phenoxymethyl}-...)
Show SMILES C(CCc1nnn[nH]1)COc1cccc(OCc2ccc3ccccc3n2)c1
Show InChI InChI=1S/C21H21N5O2/c1-2-9-20-16(6-1)11-12-17(22-20)15-28-19-8-5-7-18(14-19)27-13-4-3-10-21-23-25-26-24-21/h1-2,5-9,11-12,14H,3-4,10,13,15H2,(H,23,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
75n/an/an/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Binding affinity against Cysteinyl leukotriene D4 receptor from guinea pig lung was determined using [3H]-LTD4 (0.2 nM)


J Med Chem 33: 1186-94 (1990)


BindingDB Entry DOI: 10.7270/Q2TB15WM
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50013517
PNG
(2-{3-[4-(1H-Tetrazol-5-yl)-butoxy]-phenoxymethyl}-...)
Show SMILES C(CCc1nnn[nH]1)COc1cccc(OCc2ccc3ccccc3n2)c1
Show InChI InChI=1S/C21H21N5O2/c1-2-9-20-16(6-1)11-12-17(22-20)15-28-19-8-5-7-18(14-19)27-13-4-3-10-21-23-25-26-24-21/h1-2,5-9,11-12,14H,3-4,10,13,15H2,(H,23,24,25,26)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 120n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
Inhibition of the spasmogenic activity of LTD4 in guinea pig parenchymal strips.


J Med Chem 33: 1186-94 (1990)


BindingDB Entry DOI: 10.7270/Q2TB15WM
More data for this
Ligand-Target Pair