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4 similar compounds to monomer 25725

Compile data set for download or QSAR
Wt: 303.3
BDBM76614Purchase		Wt: 164.2
BDBM50006452Purchase		Wt: 136.1
BDBM50377117Purchase		Wt: 242.2
BDBM50379301Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 76614,50006452,50377117,50379301   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Caspase-3


(Homo sapiens (Human))		BDBM76614
PNG
(1-(4-anilinophenyl)-3-phenyl-urea | 1-(4-anilinoph...)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(Nc2ccccc2)cc1
Show InChI InChI=1S/C19H17N3O/c23-19(21-16-9-5-2-6-10-16)22-18-13-11-17(12-14-18)20-15-7-3-1-4-8-15/h1-14,20H,(H2,21,22,23)
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n/an/a 3.67E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2RJ4GZT
More data for this
Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8


(Homo sapiens (Human))		BDBM76614
PNG
(1-(4-anilinophenyl)-3-phenyl-urea | 1-(4-anilinoph...)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(Nc2ccccc2)cc1
Show InChI InChI=1S/C19H17N3O/c23-19(21-16-9-5-2-6-10-16)22-18-13-11-17(12-14-18)20-15-7-3-1-4-8-15/h1-14,20H,(H2,21,22,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2MS3R7H
More data for this
Ligand-Target Pair
SUMO-1-specific protease


(Homo sapiens (Human))		BDBM76614
PNG
(1-(4-anilinophenyl)-3-phenyl-urea | 1-(4-anilinoph...)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(Nc2ccccc2)cc1
Show InChI InChI=1S/C19H17N3O/c23-19(21-16-9-5-2-6-10-16)22-18-13-11-17(12-14-18)20-15-7-3-1-4-8-15/h1-14,20H,(H2,21,22,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q27H1H10
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))		BDBM50379301
PNG
(CHEMBL2011809)
Show SMILES Nc1cccc(NC(=O)Nc2cccc(N)c2)c1
Show InChI InChI=1S/C13H14N4O/c14-9-3-1-5-11(7-9)16-13(18)17-12-6-2-4-10(15)8-12/h1-8H,14-15H2,(H2,16,17,18)
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n/an/a 2.40E+4n/an/an/an/an/an/a



University of Siena

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DDX3 helicase activity expressed in Escherichia coli assessed as conversion of a 6-FAM-labeled double stranded RNA in...

Bioorg Med Chem Lett 22: 2094-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.135
BindingDB Entry DOI: 10.7270/Q2930V51
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))		BDBM50377117
PNG
(PHENYLUREA)
Show SMILES NC(=O)Nc1ccccc1
Show InChI InChI=1S/C7H8N2O/c8-7(10)9-6-4-2-1-3-5-6/h1-5H,(H3,8,9,10)
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n/an/a>1.00E+6n/an/an/an/an/an/a



Mayoly Spindler S.A.

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase

Bioorg Med Chem Lett 18: 3607-10 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.079
BindingDB Entry DOI: 10.7270/Q22F7PB4
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))		BDBM50379301
PNG
(CHEMBL2011809)
Show SMILES Nc1cccc(NC(=O)Nc2cccc(N)c2)c1
Show InChI InChI=1S/C13H14N4O/c14-9-3-1-5-11(7-9)16-13(18)17-12-6-2-4-10(15)8-12/h1-8H,14-15H2,(H2,16,17,18)
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n/an/a>1.00E+6n/an/an/an/an/an/a



University of Siena

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DDX3 ATPase activity expressed in Escherichia coli assessed as [gamma-32P] ATP hydrolysis after 5 mins by densitometr...

Bioorg Med Chem Lett 22: 2094-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.135
BindingDB Entry DOI: 10.7270/Q2930V51
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX1


(Homo sapiens (Human))		BDBM50379301
PNG
(CHEMBL2011809)
Show SMILES Nc1cccc(NC(=O)Nc2cccc(N)c2)c1
Show InChI InChI=1S/C13H14N4O/c14-9-3-1-5-11(7-9)16-13(18)17-12-6-2-4-10(15)8-12/h1-8H,14-15H2,(H2,16,17,18)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Siena

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DDX1 helicase activity expressed in Escherichia coli assessed as conversion of a 6-FAM-labeled double stranded RNA in...

Bioorg Med Chem Lett 22: 2094-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.135
BindingDB Entry DOI: 10.7270/Q2930V51
More data for this
Ligand-Target Pair
DNA Gyrase Subunit B


(Staphylococcus aureus)		BDBM50006452
PNG
(CHEMBL3235061)
Show SMILES CCNC(=O)Nc1ccccc1
Show InChI InChI=1S/C9H12N2O/c1-2-10-9(12)11-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,10,11,12)
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n/an/a>1.00E+6n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of ATPase activity in Staphylococcus aureus GyrB tetramer in presence of Escherichia coli GyrA by ammonium molybdate/malachite green-based...

Cell Chem Biol 56: 8712-35 (2013)


Article DOI: 10.1021/jm401208b
BindingDB Entry DOI: 10.7270/Q26H4JWF
More data for this
Ligand-Target Pair