BDBM41218 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile::2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile::2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-6-(2-furyl)nicotinonitrile::2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-6-(2-furanyl)-3-pyridinecarbonitrile::MLS000077747::SMR000042418::cid_661834

SMILES Clc1ccc(cc1)C(=O)CSc1nc(ccc1C#N)-c1ccco1

InChI Key InChIKey=ULPRZMLHHBSZMP-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 41218   

TargetDNA-directed RNA polymerase subunit beta(Escherichia coli)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM41218(2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfan...)
Affinity DataIC50: >5.00E+4nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetToll-like receptor 9(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41218(2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfan...)
Affinity DataIC50:  2.15E+4nMAssay 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
In DepthDetails PCBioAssay
TargetBeta-lactamase(Pseudomonas aeruginosa)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41218(2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfan...)
Affinity DataIC50:  1.01E+4nMAssay 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
In DepthDetails PCBioAssay