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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '15-hydroxyprostaglandin dehydrogenase [NAD(+)]' and Ligand = 'BDBM118037'   
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
15-hydroxyprostaglandin dehydrogenase [NAD(+)]


(Homo sapiens (Human))
BDBM118037
PNG
(US8637558, 60)
Show SMILES COc1cc(OCCC2CCCCC2)ccc1C=C1SC(O)=NC1=O |w:17.18,c:23|
Show InChI InChI=1S/C19H23NO4S/c1-23-16-12-15(24-10-9-13-5-3-2-4-6-13)8-7-14(16)11-17-18(21)20-19(22)25-17/h7-8,11-13H,2-6,9-10H2,1H3,(H,20,21,22)
PDB
MMDB

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Similars

US Patent
n/an/a 3.56E+3n/an/an/an/a7.5n/a



Industry-Academic Cooperation Foundation, Chosun University

US Patent


Assay Description
Experimental was performed by measuring the formation of NADH at 340 nm with a fluorescence spectrophotometer. Specifically, 2 ml (in total) of the s...


US Patent US8637558 (2014)


BindingDB Entry DOI: 10.7270/Q280519F
More data for this
Ligand-Target Pair