Compile Data Set for Download or QSAR

Found 27 hits of Enzyme Inhibition Constant Data   

TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353848(CHEMBL1831159)copy SMILEScopy InChI
Affinity DataKi:  2.13nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353845(CHEMBL1830149 | US9604926, Compound CM-341 | US972...)copy SMILEScopy InChI
Affinity DataKi:  3.28nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)copy SMILEScopy InChI
Affinity DataKi:  3.35nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353844(CHEMBL270341 | US9604926, Compound CM-145 | US9724...)copy SMILEScopy InChI
Affinity DataKi:  4.17nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353859(CHEMBL1831158)copy SMILEScopy InChI
Affinity DataKi:  5.33nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353849(CHEMBL1831160)copy SMILEScopy InChI
Affinity DataKi:  14.6nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50035105(1'-{4-[1-(4-fluorophenyl)-1H-3-indolyl]butyl}spiro...)copy SMILEScopy InChI
Affinity DataKi:  17nMAssay Description:Binding affinity to sigma 1 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353856(CHEMBL1831167)copy SMILEScopy InChI
Affinity DataKi:  34.5nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353846(CHEMBL1831156 | US9604926, Compound CM-338 | US972...)copy SMILEScopy InChI
Affinity DataKi:  71.5nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353853(CHEMBL1831164 | US9604926, Compound CM-349 | US972...)copy SMILEScopy InChI
Affinity DataKi:  90.9nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353850(CHEMBL1831161)copy SMILEScopy InChI
Affinity DataKi:  92.4nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353847(CHEMBL1831157 | US9604926, Compound CM-360 | US972...)copy SMILEScopy InChI
Affinity DataKi:  141nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353851(CHEMBL1831162)copy SMILEScopy InChI
Affinity DataKi:  222nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353857(CHEMBL1831168)copy SMILEScopy InChI
Affinity DataKi:  279nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  295nMAssay Description:Displacement of [125I]RTI-55 from human SERT expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetD(3) dopamine receptor(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  544nMAssay Description:Displacement of [3H]YM-09151-2 from human D3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353858(CHEMBL1831169)copy SMILEScopy InChI
Affinity DataKi:  614nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353852(CHEMBL1831163)copy SMILEScopy InChI
Affinity DataKi:  714nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetD(2) dopamine receptor(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  870nMAssay Description:Displacement of [3H]YM-09151-2 from human D2 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353854(CHEMBL1831165 | US9604926, Compound CM-350 | US972...)copy SMILEScopy InChI
Affinity DataKi:  1.20E+3nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
Target5-hydroxytryptamine receptor 2A(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  1.27E+3nMAssay Description:Displacement of [3H]8-OH-DPAT from human 5HT2A receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSodium-dependent noradrenaline transporter(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  1.35E+3nMAssay Description:Displacement of [125I]RTI-55 from human NET expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
Target5-hydroxytryptamine receptor 1A(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  1.51E+3nMAssay Description:Displacement of [3H]8-OH-DPAT from human 5HT1A receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  2.95E+3nMAssay Description:Displacement of (-)-[3H]pentazocine from sigma 1 receptor in rat brain membrane after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi:  5.00E+3nMAssay Description:Displacement of [125I]RTI-55 from human DAT expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetD(1A) dopamine receptor(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50353855(CHEMBL1831166 | US9604926, Compound CM-361 | US972...)copy SMILEScopy InChI
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]SCH-23390 from human D1 receptor in cell-based assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
TargetSigma non-opioid intracellular receptor 1(Homo sapiens (Human))
The University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50137618(5-Bromo-N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquin...)copy SMILEScopy InChI
Affinity DataKi:  1.29E+4nMAssay Description:Binding affinity to sigma 1 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6KRMPubMed
* indicates data uncertainty>20%