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BDBM58113 2-(1H-Benzoimidazol-2-yl)-4-benzyl-5-methyl-2,4-dihydro-pyrazol-3-one::2-(1H-benzimidazol-2-yl)-4-benzyl-5-methyl-2-pyrazolin-3-one::2-(1H-benzimidazol-2-yl)-4-benzyl-5-methyl-4H-pyrazol-3-one::2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one::CHEMBL3114983::MLS000762809::SMR000439826::cid_3915969

SMILES: Cc1[nH]n(-c2nc3ccccc3[nH]2)c(=O)c1Cc1ccccc1

InChI Key: InChIKey=CETPVAKYBIKMHV-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 58113   
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
Alpha-ketoglutarate-dependent dioxygenase alkB homolog 3


(Homo sapiens (Human))
BDBM58113
PNG
(2-(1H-Benzoimidazol-2-yl)-4-benzyl-5-methyl-2,4-di...)
Show SMILES Cc1[nH]n(-c2nc3ccccc3[nH]2)c(=O)c1Cc1ccccc1
Show InChI InChI=1S/C18H16N4O/c1-12-14(11-13-7-3-2-4-8-13)17(23)22(21-12)18-19-15-9-5-6-10-16(15)20-18/h2-10,21H,11H2,1H3,(H,19,20)
PDB
MMDB

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KEGG

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 480n/an/an/an/an/an/a



Hyogo University of Health Science

Curated by ChEMBL


Assay Description
Inhibition of demethylase activity of PCA-1 (unknown origin) using 3-methyl cytosine oligo DNA as substrate after 1 hr by RT-PCR analysis


Bioorg Med Chem Lett 24: 1071-4 (2014)


Article DOI: 10.1016/j.bmcl.2014.01.008
BindingDB Entry DOI: 10.7270/Q2FF3TVD
More data for this
Ligand-Target Pair
Streptokinase A


(Streptococcus pyogenes M1 GAS)
BDBM58113
PNG
(2-(1H-Benzoimidazol-2-yl)-4-benzyl-5-methyl-2,4-di...)
Show SMILES Cc1[nH]n(-c2nc3ccccc3[nH]2)c(=O)c1Cc1ccccc1
Show InChI InChI=1S/C18H16N4O/c1-12-14(11-13-7-3-2-4-8-13)17(23)22(21-12)18-19-15-9-5-6-10-16(15)20-18/h2-10,21H,11H2,1H3,(H,19,20)
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KEGG

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GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 1.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair