BindingDB logo
myBDB logout

BDBM118043 US8637558, 67

SMILES: OCc1ccc(C=C2SC(O)=NC2=O)cc1OCCC1CCCCC1

InChI Key: InChIKey=XNYKDVCZVOTGEM-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 118043   
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))
BDBM118043
PNG
(US8637558, 67)
Show SMILES OCc1ccc(C=C2SC(O)=NC2=O)cc1OCCC1CCCCC1 |w:6.5,c:10|
Show InChI InChI=1S/C19H23NO4S/c21-12-15-7-6-14(11-17-18(22)20-19(23)25-17)10-16(15)24-9-8-13-4-2-1-3-5-13/h6-7,10-11,13,21H,1-5,8-9,12H2,(H,20,22,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.16E+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