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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Oxoeicosanoid receptor 1' and Ligand = 'BDBM50262197'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Oxoeicosanoid receptor 1


(Homo sapiens (Human))		BDBM50262197
PNG
(CHEMBL4084871)
Show SMILES CCCCCCCCCCCc1c(C(=O)CC(C)CC(O)=O)c2cc(Cl)ccc2n1C
Show InChI InChI=1S/C26H38ClNO3/c1-4-5-6-7-8-9-10-11-12-13-23-26(24(29)16-19(2)17-25(30)31)21-18-20(27)14-15-22(21)28(23)3/h14-15,18-19H,4-13,16-17H2,1-3H3,(H,30,31)
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Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Claude Pepper Institute and Department of Chemistry, Florida Institute of Technology, 150 West University Boulevard, Melbourne, FL 32901, USA.

Curated by ChEMBL


Assay Description
Antagonist activity at OXE receptor in human neutrophils assessed as inhibition of 5-oxo-ETE-induced calcium mobilization incubated for 2 mins follow...

Bioorg Med Chem Lett 27: 4770-4776 (2017)


Article DOI: 10.1016/j.bmcl.2017.08.034
BindingDB Entry DOI: 10.7270/Q2W098DS
More data for this
Ligand-Target Pair