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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
8
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Target
5-hydroxytryptamine receptor 1E
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
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Affinity Data
IC50: 2.79E+3nM
pH: 7.4 T: 2°C
Assay Description:
To measure 5-HT1E activity, a Chinese Hamster Ovary (CHO) cell line was developed at the Scripps Molecular Research Institute Screening center. This ...
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Target
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
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Affinity Data
IC50: 2.90E+3nM
pH: 7.4 T: 2°C
Assay Description:
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...
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Target
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
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Affinity Data
IC50: 3.33E+3nM
Assay Description:
External Assay ID: S1P3_IC50_CS_5H1E_Antagonists Name: S1P3 Dose Response Assay Counterscreen for 5-Hydroxytryptamine(Serotonin) Receptor Subtype 1E ...
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Target Info
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Target
Estrogen receptor
(Homo sapiens (Human))
Emory University
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
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Affinity Data
IC50: >5.00E+4nM
Assay Description:
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...
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Target
Estrogen receptor beta
(Homo sapiens (Human))
Emory University
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
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Affinity Data
IC50: 5.00E+4nM
Assay Description:
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
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antibodypedia
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Target
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
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Affinity Data
EC50: 3.66E+3nM
Assay Description:
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...
More data for this Ligand-Target Pair
Target Info
PDB
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antibodypedia
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Copy BDB DOI
Target
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
Copy SMILES
Copy InChI
Affinity Data
EC50: 3.55E+3nM
Assay Description:
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
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PC cid
PC sid
In Depth
Details
PCBioAssay
Copy BDB DOI
Target
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM31066
(3-(1-phenyltetrazol-5-yl)sulfonylpropanenitrile | ...)
Copy SMILES
Copy InChI
Affinity Data
EC50: 1.34E+3nM
Assay Description:
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
Purchase
PC cid
PC sid
In Depth
Details
PCBioAssay
Copy BDB DOI