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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50042965'   
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
Polyunsaturated fatty acid 5-lipoxygenase


(Rattus norvegicus)
BDBM50042965
PNG
(3-(3,4-Dihydroxy-phenyl)-1-(2-pyridin-3-yl-phenyl)...)
Show SMILES Oc1ccc(\C=C\C(=O)c2ccccc2-c2cccnc2)cc1O
Show InChI InChI=1S/C20H15NO3/c22-18(9-7-14-8-10-19(23)20(24)12-14)17-6-2-1-5-16(17)15-4-3-11-21-13-15/h1-13,23-24H/b9-7+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 210n/an/an/an/an/an/a



Tokushima Bunri University

Curated by ChEMBL


Assay Description
In vitro inhibition against 5-lipoxygenase in RBL-1 cells was determined


J Med Chem 36: 3904-9 (1994)


BindingDB Entry DOI: 10.7270/Q2MS3RT4
More data for this
Ligand-Target Pair