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BDBM50317629 4-[3-{6-[3,5-Bis-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-phenoxy]-hexyl}-2-(2-carboxy-ethyl)-phenoxy]-butyric acid::CHEMBL1099329

SMILES: OC(=O)CCCOc1cccc(CCCCCCOc2cc(cc(c2)-c2ccc3OCCOc3c2)-c2ccc3OCCOc3c2)c1CCC(O)=O

InChI Key: InChIKey=OWRSXPKDANYYNU-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50317629   
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


(Homo sapiens (Human))		BDBM50317629
PNG
(4-[3-{6-[3,5-Bis-(2,3-dihydro-benzo[1,4]dioxin-6-y...)
Show SMILES OC(=O)CCCOc1cccc(CCCCCCOc2cc(cc(c2)-c2ccc3OCCOc3c2)-c2ccc3OCCOc3c2)c1CCC(O)=O
Show InChI InChI=1S/C41H44O10/c42-40(43)10-6-18-47-35-9-5-8-28(34(35)13-16-41(44)45)7-3-1-2-4-17-46-33-24-31(29-11-14-36-38(26-29)50-21-19-48-36)23-32(25-33)30-12-15-37-39(27-30)51-22-20-49-37/h5,8-9,11-12,14-15,23-27H,1-4,6-7,10,13,16-22H2,(H,42,43)(H,44,45)
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Article
PubMed
n/an/a 140n/an/an/an/an/an/a



Roche Research Center

Curated by ChEMBL


Assay Description
Antagonist activity at BLT1 receptor expressed in human HL60 cells assessed as inhibition of LTB4-stimulated calcium flux after 30 mins

J Med Chem 53: 3502-16 (2010)


Article DOI: 10.1021/jm1001919
BindingDB Entry DOI: 10.7270/Q2KW5G67
More data for this
Ligand-Target Pair