BDBM42384 2-(2-phenylethylsulfanyl)pyridine-3-carboxylic acid::2-(2-phenylethylthio)-3-pyridinecarboxylic acid::2-(phenethylthio)nicotinic acid::2-[(2-phenylethyl)thio]nicotinic acid::MLS000088004::SMR000072200::cid_888706

SMILES OC(=O)c1cccnc1SCCc1ccccc1

InChI Key InChIKey=UZERZZRWECLIKE-UHFFFAOYSA-N

Data  6 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 42384   

TargetGTPase KRas [1-37](Homo sapiens (Human))
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM42384(2-(2-phenylethylsulfanyl)pyridine-3-carboxylic aci...)
Affinity DataEC50:  142nMAssay 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...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetRas-related protein Rab-2A(Canis lupus familiaris)
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM42384(2-(2-phenylethylsulfanyl)pyridine-3-carboxylic aci...)
Affinity DataEC50:  358nMAssay 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...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetMatrix metalloproteinase-14 [1-36](Homo sapiens (Human))
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM42384(2-(2-phenylethylsulfanyl)pyridine-3-carboxylic aci...)
Affinity DataEC50:  2.01E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
LigandPNGBDBM42384(2-(2-phenylethylsulfanyl)pyridine-3-carboxylic aci...)
Affinity DataEC50:  20.2nMAssay 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...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetLysosomal acid glucosylceramidase(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM42384(2-(2-phenylethylsulfanyl)pyridine-3-carboxylic aci...)
Affinity DataEC50: >5.00E+4nMAssay 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 DepthDetails PCBioAssay
LigandPNGBDBM42384(2-(2-phenylethylsulfanyl)pyridine-3-carboxylic aci...)
Affinity DataEC50:  25.4nMAssay 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...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay