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BDBM50084814 4-(4-(7-(quinolin-2-ylmethoxy)-2-naphthamido)phenyl)butanoic acid::4-(4-{[7-(Quinolin-2-ylmethoxy)-naphthalene-2-carbonyl]-amino}-phenyl)-butyric acid::CHEMBL131611

SMILES: OC(=O)CCCc1ccc(NC(=O)c2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)cc1

InChI Key: InChIKey=OKHNULCDQJNMKH-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50084814   
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)
BDBM50084814
PNG
(4-(4-(7-(quinolin-2-ylmethoxy)-2-naphthamido)pheny...)
Show SMILES OC(=O)CCCc1ccc(NC(=O)c2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)cc1
Show InChI InChI=1S/C31H26N2O4/c34-30(35)7-3-4-21-8-14-26(15-9-21)33-31(36)24-11-10-22-13-17-28(19-25(22)18-24)37-20-27-16-12-23-5-1-2-6-29(23)32-27/h1-2,5-6,8-19H,3-4,7,20H2,(H,33,36)(H,34,35)
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PC cid
PC sid
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Similars

PubMed
1.5n/an/an/an/an/an/an/an/a



Laboratorios Menarini

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Cysteinyl leukotriene D4 receptor by using [3H]-LTD4 binding assay in guinea pig lung membranes


J Med Chem 43: 392-400 (2000)


BindingDB Entry DOI: 10.7270/Q2DJ5DVX
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50084814
PNG
(4-(4-(7-(quinolin-2-ylmethoxy)-2-naphthamido)pheny...)
Show SMILES OC(=O)CCCc1ccc(NC(=O)c2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)cc1
Show InChI InChI=1S/C31H26N2O4/c34-30(35)7-3-4-21-8-14-26(15-9-21)33-31(36)24-11-10-22-13-17-28(19-25(22)18-24)37-20-27-16-12-23-5-1-2-6-29(23)32-27/h1-2,5-6,8-19H,3-4,7,20H2,(H,33,36)(H,34,35)
PDB

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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.5n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Antagonist activity at CysLT1 receptor in human dU937 cells assessed as inhibition of LTD4-induced increase of calcium level treated 30 mins before L...


Bioorg Med Chem 18: 5519-27 (2010)


Article DOI: 10.1016/j.bmc.2010.06.047
BindingDB Entry DOI: 10.7270/Q26D5TZ0
More data for this
Ligand-Target Pair