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BDBM50057225 2-(3-(3-(quinolin-2-ylmethoxy)phenyl)acryloyl)benzoic acid::2-{(E)-3-[3-(Quinolin-2-ylmethoxy)-phenyl]-acryloyl}-benzoic acid::CHEMBL11687

SMILES: OC(=O)c1ccccc1C(=O)\C=C\c1cccc(OCc2ccc3ccccc3n2)c1

InChI Key: InChIKey=XGDMPCXGTASNNX-NTCAYCPXSA-N

Data: 1 IC50  1 Kd

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 = 50057225   
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


(Homo sapiens (Human))
BDBM50057225
PNG
(2-(3-(3-(quinolin-2-ylmethoxy)phenyl)acryloyl)benz...)
Show SMILES OC(=O)c1ccccc1C(=O)\C=C\c1cccc(OCc2ccc3ccccc3n2)c1
Show InChI InChI=1S/C26H19NO4/c28-25(22-9-2-3-10-23(22)26(29)30)15-12-18-6-5-8-21(16-18)31-17-20-14-13-19-7-1-4-11-24(19)27-20/h1-16H,17H2,(H,29,30)/b15-12+
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 31n/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Displacement of [3H]LTD4 from Cysteinyl leukotriene D4 receptor in guinea pig lung membranes


J Med Chem 40: 1075-89 (1997)


Article DOI: 10.1021/jm960628d
BindingDB Entry DOI: 10.7270/Q25141XJ
More data for this
Ligand-Target Pair
Cysteinyl leukotriene receptor


(Homo sapiens (Human))
BDBM50057225
PNG
(2-(3-(3-(quinolin-2-ylmethoxy)phenyl)acryloyl)benz...)
Show SMILES OC(=O)c1ccccc1C(=O)\C=C\c1cccc(OCc2ccc3ccccc3n2)c1
Show InChI InChI=1S/C26H19NO4/c28-25(22-9-2-3-10-23(22)26(29)30)15-12-18-6-5-8-21(16-18)31-17-20-14-13-19-7-1-4-11-24(19)27-20/h1-16H,17H2,(H,29,30)/b15-12+
PDB

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antibodypedia
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AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 31n/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