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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
6
hits in this display
Target
X-box-binding protein 1
(Homo sapiens (Human))
Emory University
Curated by
PubChem BioAssay
Ligand
BDBM46781
((3R,3aR)-2-benzoyl-3-(4-fluorobenzyl)-5-keto-4-met...)
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Affinity Data
IC50: 770nM
Assay Description:
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI
Target
DNA damage-inducible transcript 3 protein
(Mus musculus)
Emory University
Curated by
PubChem BioAssay
Ligand
BDBM46781
((3R,3aR)-2-benzoyl-3-(4-fluorobenzyl)-5-keto-4-met...)
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Copy InChI
Affinity Data
IC50: 820nM
Assay Description:
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI
Target
DNA damage-inducible transcript 3 protein
(Mus musculus)
Emory University
Curated by
PubChem BioAssay
Ligand
BDBM46781
((3R,3aR)-2-benzoyl-3-(4-fluorobenzyl)-5-keto-4-met...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 820nM
Assay Description:
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI
Target
Sphingosine 1-phosphate receptor 4
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM46781
((3R,3aR)-2-benzoyl-3-(4-fluorobenzyl)-5-keto-4-met...)
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Copy InChI
Affinity Data
IC50: 3.70E+3nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...
More data for this Ligand-Target Pair
Target Info
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI
Target
Ion channel NompC
(Danio rerio)
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM46781
((3R,3aR)-2-benzoyl-3-(4-fluorobenzyl)-5-keto-4-met...)
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Affinity Data
EC50: >1.11E+3nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/TrEMBL
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI
Target
Mucolipin-3
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM46781
((3R,3aR)-2-benzoyl-3-(4-fluorobenzyl)-5-keto-4-met...)
Copy SMILES
Copy InChI
Affinity Data
EC50: 1.12E+3nM
Assay Description:
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI