Compile Data Set for Download or QSAR
Report error Found 39 Enz. Inhib. hit(s) with all data for entry = 50023389
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataKd:  4.80nMAssay Description:Binding affinity to Bap-tagged BDK (unknown origin) assessed as dissociation constant by SPR analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50662939BDBM50662939(CHEMBL6173779)
Affinity DataIC50: 6.70nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784888BDBM784888(6-Fluoro-3-(2,4,6-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 10nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 15nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784948BDBM784948(3-(2,4-difluoro-3-methoxyphenyl)-6-fluoro-1-benzot...)
Affinity DataIC50: 20nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetBranched-chain alpha-ketoacid dehydrogenase kinase(Rattus norvegicus)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 24nMAssay Description:Inhibition of rat BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 90 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784909BDBM784909(6-Fluoro-3-(2,4,5-trifluorophenyl)-1-benzothiophen...)
Affinity DataIC50: 34nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784974BDBM784974(6-fluoro-3-(2,4,5-trifluoro-3-methylphenyl)-1-benz...)
Affinity DataIC50: 41nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetBranched-chain alpha-ketoacid dehydrogenase kinase(Mus musculus)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 41nMAssay Description:Inhibition of mouse BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 46nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50662939BDBM50662939(CHEMBL6173779)
Affinity DataIC50: 60nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784888BDBM784888(6-Fluoro-3-(2,4,6-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 67nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50662938BDBM50662938(CHEMBL6171670)
Affinity DataIC50: 110nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
LigandChemical structure of BindingDB Monomer ID 784948BDBM784948(3-(2,4-difluoro-3-methoxyphenyl)-6-fluoro-1-benzot...)
Affinity DataIC50: 210nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784974BDBM784974(6-fluoro-3-(2,4,5-trifluoro-3-methylphenyl)-1-benz...)
Affinity DataIC50: 240nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784936BDBM784936(3-(3-ethoxy-2,4-difluorophenyl)-6-fluoro-1-benzoth...)
Affinity DataIC50: 490nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50662938BDBM50662938(CHEMBL6171670)
Affinity DataIC50: 540nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetSolute carrier family 22 member 8(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 670nMAssay Description:Inhibition of human OAT3 expressed in HEK293 cells using estrone-3-sulfate as substrate preincubated for 30 mins followed by substrate addition and m...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784913BDBM784913(6-fluoro-3-(2-fluoro-3-methoxyphenyl)-1-benzothiop...)
Affinity DataIC50: 800nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784933BDBM784933(6-fluoro-3-phenyl-1-benzothiophene-2-carboxylic ac...)
Affinity DataIC50: 900nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50610696BDBM50610696(CHEMBL5281064)
Affinity DataIC50: 920nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784909BDBM784909(6-Fluoro-3-(2,4,5-trifluorophenyl)-1-benzothiophen...)
Affinity DataIC50: 950nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50424782BDBM50424782(CHEMBL1448105)
Affinity DataIC50: 1.10E+3nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
LigandChemical structure of BindingDB Monomer ID 784911BDBM784911(6-Fluoro-3-(3-methoxyphenyl)-1-benzothiophene-2-ca...)
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of human BDK using LBD-Tev-PhosphoPep/Lipoyl as substrate preincubated for 15 mins followed by substrate/ATP addition and measured after 9...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784913BDBM784913(6-fluoro-3-(2-fluoro-3-methoxyphenyl)-1-benzothiop...)
Affinity DataIC50: 3.10E+3nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetSolute carrier family 22 member 6(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 3.30E+3nMAssay Description:Inhibition of human OAT1 expressed in HEK293 cells using p-aminohippuric acid as substrate preincubated for 30 mins followed by substrate addition an...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50424782BDBM50424782(CHEMBL1448105)
Affinity DataIC50: 3.90E+3nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 4.50E+3nMAssay Description:Inhibition of human BCRP expressed in HEK293 cell vesicle using rosuvastatin as substrate preincubated for 30 mins followed by substrate addition and...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 4.50E+3nMAssay Description:Inhibition of human OATP1B1 expressed in HEK293 cells using rosuvastatin as substrate preincubated for 30 mins followed by substrate addition and mea...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 50610696BDBM50610696(CHEMBL5281064)
Affinity DataIC50: 5.60E+3nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784911BDBM784911(6-Fluoro-3-(3-methoxyphenyl)-1-benzothiophene-2-ca...)
Affinity DataIC50: 5.60E+3nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784936BDBM784936(3-(3-ethoxy-2,4-difluorophenyl)-6-fluoro-1-benzoth...)
Affinity DataIC50: 7.50E+3nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784933BDBM784933(6-fluoro-3-phenyl-1-benzothiophene-2-carboxylic ac...)
Affinity DataIC50: 6.00E+4nMAssay Description:Inhibition of BDK in human skeletal myocyte using BCKDHA as substrate assessed as inhibition of substrate phosphorylation incubated for 60 mins by Al...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetMultidrug and toxin extrusion protein 1(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 8.00E+4nMAssay Description:Inhibition of human MATE1 expressed in HEK293 cells using [14C]metformin as substrate preincubated for 30 mins followed by substrate addition and mea...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetMultidrug and toxin extrusion protein 2(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 8.00E+4nMAssay Description:Inhibition of human MATE2K expressed in HEK293 cells using [14C]metformin as substrate preincubated for 30 mins followed by substrate addition and me...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetATP-dependent translocase ABCB1(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 8.00E+4nMAssay Description:Inhibition of human MDR1 expressed in HEK293 cell vesicles using N-methylquinidine as substrate preincubated for 30 mins followed by substrate additi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 8.00E+4nMAssay Description:Inhibition of human OATP1B3 expressed in HEK293 cells using rosuvastatin as substrate preincubated for 30 mins followed by substrate addition and mea...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetSolute carrier family 22 member 1(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 8.00E+4nMAssay Description:Inhibition of human OCT1 expressed in HEK293 cells using [14C]metformin as substrate preincubated for 30 mins followed by substrate addition and meas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetSolute carrier family 22 member 2(Human)
Pfizer Inc.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 784895BDBM784895(6-Fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-ben...)
Affinity DataIC50: 8.00E+4nMAssay Description:Inhibition of human OCT2 expressed in HEK293 cells using [14C]metformin as substrate preincubated for 30 mins followed by substrate addition and meas...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed