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BDBM50266217 CHEMBL4087830

SMILES: CCC[S+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1

InChI Key: InChIKey=AZKMYLXTBNYBKD-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50266217   
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))		BDBM50266217
PNG
(CHEMBL4087830)
Show SMILES CCC[S+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C20H18N2OS3/c1-2-11-26(23)20-18(21)17-14(13-7-4-3-5-8-13)12-15(22-19(17)25-20)16-9-6-10-24-16/h3-10,12H,2,11,21H2,1H3
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Article
PubMed
n/an/a 2.10n/an/an/an/an/an/a



UT Southwestern Medical Center

Curated by ChEMBL


Assay Description
Inhibition of recombinant human C-terminal 6xHis-tagged 15-PGDH expressed in Escherichia coli using PGE2 as substrate after 15 mins in presence of NA...

J Med Chem 60: 3979-4001 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00271
BindingDB Entry DOI: 10.7270/Q2280B21
More data for this
Ligand-Target Pair