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BDBM34937 4-[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]-1-piperazinecarboxylic acid ethyl ester::4-[6-(2-hydroxyethylamino)-7-nitro-benzofurazan-4-yl]piperazine-1-carboxylic acid ethyl ester::MLS000729747::SMR000308024::cid_5206473::ethyl 4-[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]piperazine-1-carboxylate::ethyl 4-{6-[(2-hydroxyethyl)amino]-7-nitro-2,1,3-benzoxadiazol-4-yl}piperazine-1-carboxylate

SMILES: CCOC(=O)N1CCN(CC1)c1cc(NCCO)c([N+]([O-])=O)c2nonc12

InChI Key: InChIKey=UPKZIQATUXZIOK-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 34937   
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
MPI protein


(Homo sapiens (Human))
BDBM34937
PNG
(4-[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadi...)
Show SMILES CCOC(=O)N1CCN(CC1)c1cc(NCCO)c([N+]([O-])=O)c2nonc12
Show InChI InChI=1S/C15H20N6O6/c1-2-26-15(23)20-6-4-19(5-7-20)11-9-10(16-3-8-22)14(21(24)25)13-12(11)17-27-18-13/h9,16,22H,2-8H2,1H3
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/a7.423



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
The purpose of this assay is to identify non-competititve inhibitors of human PMI. This is accomplished by using a G6PD- NADPH-coupled assay. In the ...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2CF9NFM
More data for this
Ligand-Target Pair