null

SMILES NCCSC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

InChI Key InChIKey=UZCXWMDBXCJWSY-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 15 hits for monomerid = 364405   

TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  29.9nMAssay Description:Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs, Germantown, N.Y.) were removed, midbrain dissected and rapidly frozen. Membran...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2PR7Z87US Patent
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  29.9nMAssay Description:Serotonin Transporter Binding Assay. Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs, Germantown, N.Y.) were removed, midbrain ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2ST7TRGUS Patent
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  29.9nMAssay Description:Serotonin Transporter Binding Assay. Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs, Germantown, N.Y.) were removed, midbrain ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2F47S7BUS Patent
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  30nMAssay Description:Displacement of [3H]citalopram from Sprague-Dawley rat brain SERT after 60 mins by liquid scintillation counting analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JM2DMKPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  170nMAssay Description:Binding affinity to human SERT T497A mutant expressed in African green monkey COS7 cells assessed as inhibition of [3H]-serotonin uptake after 3 mins...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JM2DMKPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  270nMAssay Description:Binding affinity to wild type human SERT expressed in African green monkey COS7 cells assessed as inhibition of [3H]-serotonin uptake after 3 mins by...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JM2DMKPubMed
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  296nMAssay Description:Displacement of [3H]WIN35,428 from Sprague-Dawley rat brain DAT after 120 mins by liquid scintillation counting analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JM2DMKPubMed
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  298nMAssay Description:Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs) were removed, striatum dissected and quickly frozen. Membranes were prepared b...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2PR7Z87US Patent
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  298nMAssay Description:Dopamine Transporter Binding Assay. Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs) were removed, striatum dissected and quick...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2F47S7BUS Patent
TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  298nMAssay Description:Dopamine Transporter Binding Assay. Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs) were removed, striatum dissected and quick...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2ST7TRGUS Patent
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  1.21E+3nMAssay Description:Binding affinity to wild type human DAT expressed in African green monkey COS7 cells assessed as inhibition of [3H]-dopamine uptake after 5 mins by b...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JM2DMKPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  1.37E+3nMAssay Description:Binding affinity to human DAT A480T mutant expressed in African green monkey COS7 cells assessed as inhibition of [3H]-dopamine uptake after 5 mins b...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JM2DMKPubMed
TargetNeuroepithelial cell-transforming 1(Rat)
THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES

US Patent
LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  6.97E+3nMAssay Description:Norepinephrine Transporter Binding Assay. Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs, Germantown, N.Y.) were removed, fron...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2F47S7BUS Patent
TargetTransporter(Rattus norvegicus (rat))
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  6.97E+3nMAssay Description:Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs, Germantown, N.Y.) were removed, frontal cortex dissected and rapidly frozen. M...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2PR7Z87US Patent
TargetTransporter(Rattus norvegicus (rat))
Rheinische Friedrich-Wilhelms-Universitat Bonn

LigandPNGBDBM364405(US10913711, Compound 4b | US11555013, Compound 4b ...)copy SMILEScopy InChI
Affinity DataKi:  6.97E+3nMAssay Description:Norepinephrine Transporter Binding Assay. Brains from male Sprague-Dawley rats weighing 200-225 g (Taconic Labs, Germantown, N.Y.) were removed, fron...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2ST7TRGUS Patent