null

SMILES CCOC(=O)c1sc(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(C#N)c1C

InChI Key InChIKey=XTDMSJJFEQHMRK-UHFFFAOYSA-N

  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 23 hits for monomerid = 34435   

TargetRegulator of G-protein signaling 19(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataKi:  140nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26T0K2PPCBioAssay
TargetRegulator of G-protein signaling 8(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataKi:  150nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2G73C4VPCBioAssay
TargetRegulator of G-protein signaling 16(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataKi:  580nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2QR4VJRPCBioAssay
TargetRegulator of G-protein signaling 4(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataKi:  6.68E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q27P8WVPPCBioAssay
TargetRegulator of G-protein signaling 8(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  6.70E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2TM78JDPCBioAssay
TargetRegulator of G-protein signaling 4(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2F76B0GPCBioAssay
TargetRegulator of G-protein signaling 4(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  7.85E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2CF9NJZPCBioAssay
TargetRegulator of G-protein signaling 4(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2CF9NJZPCBioAssay
TargetRegulator of G-protein signaling 7(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2416VG3PCBioAssay
TargetRegulator of G-protein signaling 7(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2416VG3PCBioAssay
TargetRegulator of G-protein signaling 16(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  714nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VH5M8GPCBioAssay
TargetRegulator of G-protein signaling 16(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2VH5M8GPCBioAssay
TargetRegulator of G-protein signaling 8(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  181nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2M043TQPCBioAssay
TargetRegulator of G-protein signaling 8(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2M043TQPCBioAssay
TargetRegulator of G-protein signaling 19(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  155nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2BG2MFKPCBioAssay
TargetGlucose-6-phosphate 1-dehydrogenase(Homo sapiens (Human))
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataIC50: 8.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2V12389PCBioAssay
TargetGlucose-6-phosphate dehydrogenase-6-phosphogluconolactonase(Plasmodium falciparum 3D7)
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataIC50: 4.72E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2ZS2TZGPCBioAssay
TargetGlucose-6-phosphate dehydrogenase-6-phosphogluconolactonase(Plasmodium falciparum 3D7)
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataIC50: 8.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q27H1H3WPCBioAssay
TargetRegulator of G-protein signaling 16(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  1.34E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2FB51BWPCBioAssay
TargetRegulator of G-protein signaling 19(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50:  1.42E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2K35S27PCBioAssay
TargetGlucose-6-phosphate dehydrogenase-6-phosphogluconolactonase(Plasmodium falciparum 3D7)
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataIC50: 8.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q23T9FQ1PCBioAssay
TargetGag-Pol polyprotein(Human immunodeficiency virus type 1 group M subtyp...)
University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataIC50: 94.0nMpH: 8.0 T: 2°CAssay Description:A fluorescence resonance energy transfer assay is developed in 96-well and 384-well microplate formats with robotic manipulation to enable high-throu...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2H70D5WPCBioAssay
TargetRegulator of G-protein signaling 7(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM34435(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)copy SMILEScopy InChI
Affinity DataEC50: >3.00E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2PV6HS7PCBioAssay