Compile Data Set for Download or QSAR
Found 77 with Last Name = 'entrena' and Initial = 'jm'
TargetVesicular acetylcholine transporter(Rattus norvegicus)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50359391(CHEMBL1929421)copy SMILEScopy InChI
Affinity DataKi:  2.60nMAssay Description:Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma non-opioid intracellular receptor 1(Homo sapiens (Human))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50359391(CHEMBL1929421)copy SMILEScopy InChI
Affinity DataKi:  2.80nMAssay Description:Displacement of (+)-[3H]pentazocine from human sigma1 receptor expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting meth...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)copy SMILEScopy InChI
Affinity DataKi:  5.40nMAssay Description:Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
TargetSigma non-opioid intracellular receptor 1(Homo sapiens (Human))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)copy SMILEScopy InChI
Affinity DataKi:  5.90nMAssay Description:Displacement of (+)-[3H]pentazocine from human sigma1 receptor expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting meth...More data for this Ligand-Target Pair
TargetHistamine H3 receptor(Homo sapiens (Human))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50281388(CHEMBL4173258)copy SMILEScopy InChI
Affinity DataKi:  11nMAssay Description:Displacement of [3H]-N-alpha-methylhistamine from human H3R expressed in HEK293 cell membranes after 90 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50338990(1-(3,4-dimethoxyphenethyl)-4-(3-phenylpropyl)piper...)copy SMILEScopy InChI
Affinity DataKi:  14nMAssay Description:Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50018078(2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...)copy SMILEScopy InChI
Affinity DataKi:  27nMAssay Description:Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma intracellular receptor 2(Rattus norvegicus (Rat))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50062551(CHEBI:76010 | Dolutegravir | GSK1349572 | S-349572)copy SMILEScopy InChI
Affinity DataKi:  32nMAssay Description:Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma intracellular receptor 2(Rattus norvegicus (Rat))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)copy SMILEScopy InChI
Affinity DataKi:  44nMAssay Description:Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetVesicular acetylcholine transporter(Rattus norvegicus)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50281388(CHEMBL4173258)copy SMILEScopy InChI
Affinity DataKi:  46nMAssay Description:Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetVesicular acetylcholine transporter(Rattus norvegicus)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50018078(2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...)copy SMILEScopy InChI
Affinity DataKi:  49nMAssay Description:Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma intracellular receptor 2(Rattus norvegicus (Rat))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50359391(CHEMBL1929421)copy SMILEScopy InChI
Affinity DataKi:  50nMAssay Description:Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma intracellular receptor 2(Rattus norvegicus (Rat))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50338990(1-(3,4-dimethoxyphenethyl)-4-(3-phenylpropyl)piper...)copy SMILEScopy InChI
Affinity DataKi:  62nMAssay Description:Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma intracellular receptor 2(Rattus norvegicus (Rat))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50018078(2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...)copy SMILEScopy InChI
Affinity DataKi:  63nMAssay Description:Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma non-opioid intracellular receptor 1(Homo sapiens (Human))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50281388(CHEMBL4173258)copy SMILEScopy InChI
Affinity DataKi:  65nMAssay Description:Displacement of (+)-[3H]pentazocine from human sigma1 receptor expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting meth...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma non-opioid intracellular receptor 1(RAT)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50062551(CHEBI:76010 | Dolutegravir | GSK1349572 | S-349572)copy SMILEScopy InChI
Affinity DataKi:  217nMAssay Description:Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetSigma intracellular receptor 2(Rattus norvegicus (Rat))
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50281388(CHEMBL4173258)copy SMILEScopy InChI
Affinity DataKi:  326nMAssay Description:Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetVesicular acetylcholine transporter(Rattus norvegicus)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)copy SMILEScopy InChI
Affinity DataKi:  391nMAssay Description:Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetVesicular acetylcholine transporter(Rattus norvegicus)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50338990(1-(3,4-dimethoxyphenethyl)-4-(3-phenylpropyl)piper...)copy SMILEScopy InChI
Affinity DataKi:  492nMAssay Description:Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetVesicular acetylcholine transporter(Rattus norvegicus)
IQOG, CSIC

Curated by ChEMBL
LigandPNGBDBM50062551(CHEBI:76010 | Dolutegravir | GSK1349572 | S-349572)copy SMILEScopy InChI
Affinity DataKi:  4.52E+3nMAssay Description:Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2QN699QPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM409005(US10377744, Compound No. 26 | US11123311, Compound...)copy SMILEScopy InChI
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM158481(US9029401, 1728 (t-TUCB))copy SMILEScopy InChI
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591327(CHEMBL5177544)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591330(CHEMBL5197431)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591331(CHEMBL5197282)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591334(CHEMBL5191146)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591336(CHEMBL5179027)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591337(CHEMBL5192445)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591340(CHEMBL5203787)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591341(CHEMBL5177372)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591344(CHEMBL5208857)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591331(CHEMBL5197282)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591336(CHEMBL5179027)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591337(CHEMBL5192445)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591341(CHEMBL5177372)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591344(CHEMBL5208857)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591345(CHEMBL5196519)copy SMILES
Affinity DataIC50: 0.400nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591340(CHEMBL5203787)copy SMILES
Affinity DataIC50: 0.5nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591345(CHEMBL5196519)copy SMILES
Affinity DataIC50: 0.5nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50217448(CHEMBL242459 | US9029401, 1471 (t-AUCB) | trans-4-...)copy SMILEScopy InChI
Affinity DataIC50: 0.5nMMore data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591338(CHEMBL5203245)copy SMILES
Affinity DataIC50: 0.600nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591335(CHEMBL5179500)copy SMILES
Affinity DataIC50: 0.600nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591333(CHEMBL5197313)copy SMILES
Affinity DataIC50: 0.600nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591338(CHEMBL5203245)copy SMILES
Affinity DataIC50: 0.800nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591332(CHEMBL5195267)copy SMILES
Affinity DataIC50: 0.800nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591329(CHEMBL5179393)copy SMILES
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591333(CHEMBL5197313)copy SMILES
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591334(CHEMBL5191146)copy SMILES
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Mus musculus (Mouse))TBA
LigandPNGBDBM50591343(CHEMBL5209279)copy SMILES
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))TBA
LigandPNGBDBM50591328(CHEMBL5193653)copy SMILES
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q21R6VHVPubMed
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