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BDBM118014 US8637558, 10

SMILES: COc1cc(C=C2SC(O)=NC2=O)cc(CO)c1OCCC1CCCCC1

InChI Key: InChIKey=UGZSUJMPLHTBCB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 118014   
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
15-hydroxyprostaglandin dehydrogenase [NAD(+)]


(Homo sapiens (Human))
BDBM118014
PNG
(US8637558, 10)
Show SMILES COc1cc(C=C2SC(O)=NC2=O)cc(CO)c1OCCC1CCCCC1 |w:5.4,c:9|
Show InChI InChI=1S/C20H25NO5S/c1-25-16-10-14(11-17-19(23)21-20(24)27-17)9-15(12-22)18(16)26-8-7-13-5-3-2-4-6-13/h9-11,13,22H,2-8,12H2,1H3,(H,21,23,24)
PDB
MMDB

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Similars

US Patent
n/an/a 94.5n/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