BDBM65821 2-[5-(benzylthio)-4-(2-thenyl)-1,2,4-triazol-3-yl]pyridine::2-[5-(phenylmethylsulfanyl)-4-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine::2-[5-(phenylmethylthio)-4-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine::2-[5-benzylsulfanyl-4-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine::KSC-5-247A::KUC103897N::cid_44601467

SMILES C(Sc1nnc(-c2ccccn2)n1Cc1cccs1)c1ccccc1

InChI Key InChIKey=YTDFSDPAYZLWFT-UHFFFAOYSA-N

Data  1 IC50  4 EC50

  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 5 hits for monomerid = 65821   

TargetKappa-type opioid receptor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM65821(2-[5-(benzylthio)-4-(2-thenyl)-1,2,4-triazol-3-yl]...)
Affinity DataIC50: >3.20E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetMu-type opioid receptor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM65821(2-[5-(benzylthio)-4-(2-thenyl)-1,2,4-triazol-3-yl]...)
Affinity DataEC50: >3.20E+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
TargetKappa-type opioid receptor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM65821(2-[5-(benzylthio)-4-(2-thenyl)-1,2,4-triazol-3-yl]...)
Affinity DataEC50:  1.39E+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
TargetKappa-type opioid receptor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM65821(2-[5-(benzylthio)-4-(2-thenyl)-1,2,4-triazol-3-yl]...)
Affinity DataEC50:  2.35E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetDelta-type opioid receptor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM65821(2-[5-(benzylthio)-4-(2-thenyl)-1,2,4-triazol-3-yl]...)
Affinity DataEC50: >3.20E+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