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BDBM50013536 2-{4-[4-(1H-Tetrazol-5-yl)-butyl]-phenoxymethyl}-quinoline::2-{4-[4-(2H-Tetrazol-5-yl)-butyl]-phenoxymethyl}-quinoline::CHEMBL97541

SMILES: C(CCc1ccc(OCc2ccc3ccccc3n2)cc1)Cc1nnn[nH]1

InChI Key: InChIKey=URIMHZHMIDRURZ-UHFFFAOYSA-N

Data: 2 KI  1 IC50

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

Found 3 hits for monomerid = 50013536   
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)
BDBM50013536
PNG
(2-{4-[4-(1H-Tetrazol-5-yl)-butyl]-phenoxymethyl}-q...)
Show SMILES C(CCc1ccc(OCc2ccc3ccccc3n2)cc1)Cc1nnn[nH]1
Show InChI InChI=1S/C21H21N5O/c1(4-8-21-23-25-26-24-21)5-16-9-13-19(14-10-16)27-15-18-12-11-17-6-2-3-7-20(17)22-18/h2-3,6-7,9-14H,1,4-5,8,15H2,(H,23,24,25,26)
PDB

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CHEMBL
PC cid
PC sid
UniChem

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PubMed
18n/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))
BDBM50013536
PNG
(2-{4-[4-(1H-Tetrazol-5-yl)-butyl]-phenoxymethyl}-q...)
Show SMILES C(CCc1ccc(OCc2ccc3ccccc3n2)cc1)Cc1nnn[nH]1
Show InChI InChI=1S/C21H21N5O/c1(4-8-21-23-25-26-24-21)5-16-9-13-19(14-10-16)27-15-18-12-11-17-6-2-3-7-20(17)22-18/h2-3,6-7,9-14H,1,4-5,8,15H2,(H,23,24,25,26)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
18n/an/an/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
In vitro binding affinity against cysteinyl leukotriene D4 receptor from guinea pig lung membrane


J Med Chem 33: 2828-41 (1990)


BindingDB Entry DOI: 10.7270/Q29C6WDM
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50013536
PNG
(2-{4-[4-(1H-Tetrazol-5-yl)-butyl]-phenoxymethyl}-q...)
Show SMILES C(CCc1ccc(OCc2ccc3ccccc3n2)cc1)Cc1nnn[nH]1
Show InChI InChI=1S/C21H21N5O/c1(4-8-21-23-25-26-24-21)5-16-9-13-19(14-10-16)27-15-18-12-11-17-6-2-3-7-20(17)22-18/h2-3,6-7,9-14H,1,4-5,8,15H2,(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 36n/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