BDBM41598 4-[1-oxo-2-[[2-oxo-2-[[4-(4-phenylphenyl)-2-thiazolyl]amino]ethyl]thio]ethyl]-1-piperazinecarboxylic acid ethyl ester::4-[2-[[2-keto-2-[[4-(4-phenylphenyl)thiazol-2-yl]amino]ethyl]thio]acetyl]piperazine-1-carboxylic acid ethyl ester::MLS000529745::SMR000126825::cid_5235407::ethyl 4-[2-[2-oxidanylidene-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl]sulfanylethanoyl]piperazine-1-carboxylate::ethyl 4-[2-[2-oxo-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl]sulfanylacetyl]piperazine-1-carboxylate

SMILES CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)Nc1nc(cs1)-c1ccc(cc1)-c1ccccc1

InChI Key InChIKey=APVKJTYNBUKNKK-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 41598   

TargetSphingosine 1-phosphate receptor 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41598(MLS000529745 | ethyl 4-[2-[2-oxo-2-[[4-(4-phenylph...)
Affinity DataIC50: 2.47E+3nMAssay 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
In Depth
Date in BDB:
5/12/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41598(MLS000529745 | ethyl 4-[2-[2-oxo-2-[[4-(4-phenylph...)
Affinity DataIC50: 873nMAssay 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
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetNeutrophil cytosol factor 1 [S99G](Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM41598(MLS000529745 | ethyl 4-[2-[2-oxo-2-[[4-(4-phenylph...)
Affinity DataIC50: 5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Susan Smith, Emory Univers...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/7/2011
Entry Details
PCBioAssay
TargetCOUP transcription factor 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41598(MLS000529745 | ethyl 4-[2-[2-oxo-2-[[4-(4-phenylph...)
Affinity DataIC50: 5.66E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2013
Entry Details
PCBioAssay
TargetTegument protein VP16(HHV-1)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41598(MLS000529745 | ethyl 4-[2-[2-oxo-2-[[4-(4-phenylph...)
Affinity DataIC50: 2.84E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/8/2014
Entry Details
PCBioAssay