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Compile Data Set for Download or QSAR
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
18
hits in this display
Target
Dihydrolipoyl dehydrogenase
(Mycobacterium tuberculosis)
Academia Sinica
US Patent
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: <40nM
pH: 7.0
Assay Description:
The assay was performed in a manner similar to that described in Bryk et al., Biochemistry (2010) 49:1616-1627 and modified for an online robotics sc...
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Target
Dihydrolipoyllysine-residue acetyltransferase component of pyruvate dehydrogenase complex
(Mycobacterium tuberculosis)
Academia Sinica
US Patent
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: <40nM
pH: 7.0
Assay Description:
Mtb PDH (Lpd+DlaT+AceE) is provided by Dr. Bryk Ruslana. The assay was performed in a manner similar to that described in Bryk et al., Biochemistry (...
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Target
Caspase-9
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 51.9nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...
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KEGG
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antibodypedia
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Target
Apoptotic protease-activating factor 1
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 57.2nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...
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Target
Cysteine protease ATG4B
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 653nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...
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Target
Dual specificity protein phosphatase 3
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 2.24E+3nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...
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Target
Tegument protein VP16
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 5.14E+3nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...
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Target
Protein RecA
(Mycobacterium tuberculosis H37Rv)
Southern Research Specialized Biocontainment Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 6.39E+3nM
Assay Description:
Southern Research's Specialized Biocontainment Screening Center (SRSBSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Librarie...
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Target
Tyrosine-protein phosphatase non-receptor type 7
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 1.03E+4nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...
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Target
Tyrosine-protein phosphatase non-receptor type 22
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 1.17E+4nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...
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Target
Tyrosine-protein phosphatase non-receptor type 22
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 1.30E+4nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...
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Target
Nuclear receptor coactivator 1
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: >3.59E+4nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...
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Target
Nuclear receptor coactivator 3
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: >3.59E+4nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...
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Target
Tyrosine-protein kinase ABL1
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: >7.35E+4nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Phospholipase A2
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: >8.00E+4nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...
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Target Info
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Target
Apoptotic protease-activating factor 1
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
Copy SMILES
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Affinity Data
IC50: >1.00E+5nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...
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Target Info
PDB
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Target
Dual specificity protein phosphatase 3
(Homo sapiens (Human))
Burnham Center For Chemical Genomics
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
IC50: 1.06E+5nM
Assay Description:
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...
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Target
Cell division control protein 42 homolog
(Homo sapiens (Human))
Nmmlsc
Curated by
PubChem BioAssay
Ligand
BDBM43224
(1-ethyl-6-methyl-3-[(E)-2-phenylethenyl]pyrimido[5...)
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Affinity Data
EC50: 1.44E+3nM
Assay Description:
University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...
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