Compile Data Set for Download or QSAR
Report error Found 34 Enz. Inhib. hit(s) with all data for entry = 50046218
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100556BDBM50100556(CHEMBL3321845)
Affinity DataEC50:  3.5nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100557BDBM50100557(CHEMBL3321846)
Affinity DataEC50:  3.90nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100558BDBM50100558(CHEMBL3321850)
Affinity DataEC50:  5.10nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50121975BDBM50121975((6-Methoxy-quinolin-4-yl)-(5-vinyl-1-aza-bicyclo[2...)
Affinity DataIC50: 6nMAssay Description:Inhibition of CYP2D6 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100563BDBM50100563(CHEMBL3321841)
Affinity DataEC50:  6.10nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100560BDBM50100560(CHEMBL3321843)
Affinity DataEC50:  12nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100561BDBM50100561(CHEMBL3321758)
Affinity DataEC50:  20nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100559BDBM50100559(CHEMBL3321844)
Affinity DataEC50:  41nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50399945BDBM50399945(CHEMBL2181251)
Affinity DataEC50:  48nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 31768BDBM31768(Nizoral | CHEMBL295698 | Panfungol | Ketoconazole)
Affinity DataIC50: 62nMAssay Description:Inhibition of CYP3A4 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100568BDBM50100568(CHEMBL3356914)
Affinity DataEC50:  122nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100567BDBM50100567(CHEMBL3321849)
Affinity DataEC50:  178nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50090677BDBM50090677(CHEMBL1109 | 4-Amino-N-(2-phenyl-2H-pyrazol-3-yl)-...)
Affinity DataIC50: 180nMAssay Description:Inhibition of CYP2C9 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100556BDBM50100556(CHEMBL3321845)
Affinity DataIC50: 250nMAssay Description:Inhibition of CYP3A4 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100557BDBM50100557(CHEMBL3321846)
Affinity DataIC50: 260nMAssay Description:Inhibition of CYP3A4 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100558BDBM50100558(CHEMBL3321850)
Affinity DataIC50: 270nMAssay Description:Inhibition of CYP3A4 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50300199BDBM50300199(6alpha-ethyl-23(S)-methyl-cholic acid | CHEMBL5676...)
Affinity DataEC50:  293nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetCytochrome P450 2C19(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100558BDBM50100558(CHEMBL3321850)
Affinity DataIC50: 780nMAssay Description:Inhibition of CYP2C19 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100562BDBM50100562(CHEMBL3321842)
Affinity DataEC50: >1.00E+3nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100564BDBM50100564(CHEMBL3321847)
Affinity DataEC50: >1.00E+3nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetG-protein coupled bile acid receptor 1(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100566BDBM50100566(CHEMBL3321848)
Affinity DataEC50: >1.00E+3nMAssay Description:Agonist activity at human TGR5 expressed in HEK293 cells assessed as cAMP level after 48 hrs by fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100557BDBM50100557(CHEMBL3321846)
Affinity DataIC50: 1.29E+3nMAssay Description:Inhibition of CYP2C9 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100556BDBM50100556(CHEMBL3321845)
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of CYP2C9 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100558BDBM50100558(CHEMBL3321850)
Affinity DataIC50: 1.54E+3nMAssay Description:Inhibition of CYP2C9 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100556BDBM50100556(CHEMBL3321845)
Affinity DataIC50: 1.61E+3nMAssay Description:Inhibition of CYP2C19 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50240772BDBM50240772((1R,2S)-2-phenylcyclopropanamine | cid_2723716 | (...)
Affinity DataIC50: 1.90E+3nMAssay Description:Inhibition of CYP2C19 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50236897BDBM50236897(furafylline | 3-(furan-2-ylmethyl)-1,8-dimethyl-1H...)
Affinity DataIC50: 3.62E+3nMAssay Description:Inhibition of CYP1A2 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100558BDBM50100558(CHEMBL3321850)
Affinity DataIC50: 9.62E+3nMAssay Description:Inhibition of CYP2D6 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100557BDBM50100557(CHEMBL3321846)
Affinity DataIC50: 1.67E+4nMAssay Description:Inhibition of CYP2C19 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100556BDBM50100556(CHEMBL3321845)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100557BDBM50100557(CHEMBL3321846)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100556BDBM50100556(CHEMBL3321845)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100557BDBM50100557(CHEMBL3321846)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Chung-Ang University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50100558BDBM50100558(CHEMBL3321850)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2016
Entry Details Article
PubMed