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SMILES: CCCc1c(OCCCOc2ccc3CCC(CCC(O)=O)Oc3c2CCC)ccc(-c2cscn2)c1OC

InChI Key: InChIKey=QXRBKLSXANWSNZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033749   
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 1


(Homo sapiens (Human))		BDBM50033749
PNG
(3-{7-[3-(3-Methoxy-2-propyl-4-thiazol-4-yl-phenoxy...)
Show SMILES CCCc1c(OCCCOc2ccc3CCC(CCC(O)=O)Oc3c2CCC)ccc(-c2cscn2)c1OC
Show InChI InChI=1S/C31H39NO6S/c1-4-7-24-27(14-10-21-9-11-22(38-30(21)24)12-16-29(33)34)36-17-6-18-37-28-15-13-23(26-19-39-20-32-26)31(35-3)25(28)8-5-2/h10,13-15,19-20,22H,4-9,11-12,16-18H2,1-3H3,(H,33,34)
PDB

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antibodypedia
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PC cid
PC sid
UniChem

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Similars
PubMed
n/an/a 26n/an/an/an/an/an/a



Searle Research and Development

Curated by ChEMBL


Assay Description
Binding affinity for Leukotriene B4 (LTB4) receptor

J Med Chem 38: 858-68 (1995)


BindingDB Entry DOI: 10.7270/Q22806N0
More data for this
Ligand-Target Pair