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BDBM50060898 5,8-Dihydroxy-[1,4]naphthoquinone::5,8-dihydroxy-1,4-dihydronaphthalene-1,4-dione (7a)::5,8-dihydroxy-1,4-naphthoquinone::CHEMBL274056::naphthazalin

SMILES: Oc1ccc(O)c2C(=O)C=CC(=O)c12

InChI Key: InChIKey=RQNVIKXOOKXAJQ-UHFFFAOYSA-N

Data: 6 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50060898   
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
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50060898
PNG
(5,8-Dihydroxy-[1,4]naphthoquinone | 5,8-dihydroxy-...)
Show SMILES Oc1ccc(O)c2C(=O)C=CC(=O)c12
Show InChI InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H
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Article
PubMed
n/an/a 3.19E+3n/an/an/an/an/an/a



North-West University



Assay Description
The protocol for measuring IC50 values for the inhibition of MAO-A and MAO-B has been reported in detail in a recent publication (26). The recombinan...


Chem Biol Drug Des 87: 737-46 (2016)


Article DOI: 10.1111/cbdd.12708
BindingDB Entry DOI: 10.7270/Q2MG7N84
More data for this
Ligand-Target Pair
Monoamine oxidase B (MAO-B)


(Homo sapiens (Human))
BDBM50060898
PNG
(5,8-Dihydroxy-[1,4]naphthoquinone | 5,8-dihydroxy-...)
Show SMILES Oc1ccc(O)c2C(=O)C=CC(=O)c12
Show InChI InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H
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n/an/a 860n/an/an/an/an/an/a



North-West University



Assay Description
The protocol for measuring IC50 values for the inhibition of MAO-A and MAO-B has been reported in detail in a recent publication (26). The recombinan...


Chem Biol Drug Des 87: 737-46 (2016)


Article DOI: 10.1111/cbdd.12708
BindingDB Entry DOI: 10.7270/Q2MG7N84
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 1


(Mus musculus)
BDBM50060898
PNG
(5,8-Dihydroxy-[1,4]naphthoquinone | 5,8-dihydroxy-...)
Show SMILES Oc1ccc(O)c2C(=O)C=CC(=O)c12
Show InChI InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H
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Article
PubMed
n/an/a 9.37E+3n/an/an/an/an/an/a



Virginia Polytechnic Institute and State University

Curated by ChEMBL


Assay Description
Inhibition of histidine-tagged mouse MKP1 catalytic domain expressed in human Hela cells


Bioorg Med Chem 17: 2276-81 (2009)


Article DOI: 10.1016/j.bmc.2008.10.090
BindingDB Entry DOI: 10.7270/Q21J99MN
More data for this
Ligand-Target Pair
Dual specificity phosphatase Cdc25B


(Homo sapiens (Human))
BDBM50060898
PNG
(5,8-Dihydroxy-[1,4]naphthoquinone | 5,8-dihydroxy-...)
Show SMILES Oc1ccc(O)c2C(=O)C=CC(=O)c12
Show InChI InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H
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Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Virginia Polytechnic Institute and State University

Curated by ChEMBL


Assay Description
Inhibition of histidine-tagged human recombinant Cdc25B catalytic domain expressed in Escherichia coli


Bioorg Med Chem 17: 2276-81 (2009)


Article DOI: 10.1016/j.bmc.2008.10.090
BindingDB Entry DOI: 10.7270/Q21J99MN
More data for this
Ligand-Target Pair
MKP-3


(Rattus norvegicus)
BDBM50060898
PNG
(5,8-Dihydroxy-[1,4]naphthoquinone | 5,8-dihydroxy-...)
Show SMILES Oc1ccc(O)c2C(=O)C=CC(=O)c12
Show InChI InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H
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Article
PubMed
n/an/a 6.90E+3n/an/an/an/an/an/a



Virginia Polytechnic Institute and State University

Curated by ChEMBL


Assay Description
Inhibition of histidine-tagged rat recombinant MKP3 catalytic domain expressed in Escherichia coli BL21(DE3)


Bioorg Med Chem 17: 2276-81 (2009)


Article DOI: 10.1016/j.bmc.2008.10.090
BindingDB Entry DOI: 10.7270/Q21J99MN
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Bos taurus)
BDBM50060898
PNG
(5,8-Dihydroxy-[1,4]naphthoquinone | 5,8-dihydroxy-...)
Show SMILES Oc1ccc(O)c2C(=O)C=CC(=O)c12
Show InChI InChI=1S/C10H6O4/c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10/h1-4,11-12H
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Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Westfälische Wilhelms-Universität Münster

Curated by ChEMBL


Assay Description
5-LO inhibitory activity was determined by inhibition of LTB4 biosynthesis in bovine polymorphonuclear leukocytes (PMNL)


J Med Chem 40: 3773-80 (1997)


Article DOI: 10.1021/jm970292n
BindingDB Entry DOI: 10.7270/Q20R9NJN
More data for this
Ligand-Target Pair