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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Oxoeicosanoid receptor 1' and Ligand = 'BDBM50446976'   
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))
BDBM50446976
PNG
(CHEMBL3115777 | CHEMBL3115778)
Show SMILES CCCCC\C=C/C[C@H](O)\C=C\C=CC=CC(=O)CCCC(O)=O |r,w:15.15,13.13|
Show InChI InChI=1S/C20H30O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,18,21H,2-5,12-13,16-17H2,1H3,(H,23,24)/b8-7?,9-6-,14-10+,15-11?/t18-/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 500n/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Antagonist activity at OXE receptor in human neutrophils assessed as inhibition of 5-oxo-ETE-induced calcium mobilization by spectrofluorometric anal...


J Med Chem 57: 364-77 (2014)


Article DOI: 10.1021/jm401292m
BindingDB Entry DOI: 10.7270/Q2N87C82
More data for this
Ligand-Target Pair
Oxoeicosanoid receptor 1


(Homo sapiens (Human))
BDBM50446976
PNG
(CHEMBL3115777 | CHEMBL3115778)
Show SMILES CCCCC\C=C/C[C@H](O)\C=C\C=CC=CC(=O)CCCC(O)=O |r,w:15.15,13.13|
Show InChI InChI=1S/C20H30O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,18,21H,2-5,12-13,16-17H2,1H3,(H,23,24)/b8-7?,9-6-,14-10+,15-11?/t18-/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Antagonist activity at OXE receptor in human neutrophils assessed as inhibition of 5-oxo-ETE-induced calcium mobilization by spectrofluorometric anal...


J Med Chem 57: 364-77 (2014)


Article DOI: 10.1021/jm401292m
BindingDB Entry DOI: 10.7270/Q2N87C82
More data for this
Ligand-Target Pair