BDBM249466 US10072016, Compound 65::US10407433, Compound 65::US10913746, Compound 65::US11649240, Compound 65::US9434727, 65::US9777010, Compound 65

SMILES Fc1cccc(C2CCN(CC2)C(=O)c2nnc3ccc(cn23)C#N)c1C(F)(F)F

InChI Key InChIKey=TZIIUZZREBUIBM-UHFFFAOYSA-N

Data  1 KI  44 IC50

  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 45 hits for monomerid = 249466   

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2021
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/27/2020
Entry Details
Go to US Patent

TargetCytochrome P450 3A4(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 7.40E+4nMAssay Description:Inhibition of recombinant human CYP3A4 expressed in insect cell microsomes in presence of NADPH-regenerating system after 15 to 45 mins by fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 2.20E+4nMAssay Description:Inhibition of recombinant human CYP2C19 expressed in insect cell microsomes in presence of NADPH-regenerating system after 15 to 45 mins by fluoresce...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of recombinant human CYP2D6 expressed in insect cell microsomes in presence of NADPH-regenerating system after 15 to 45 mins by fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of human ERG expressed in HEK293 cells at -80 mV holding potential by PatchXpress automated electrophysiology methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 2.90E+3nMAssay Description:Time dependent inhibition of CYP2D6 in human liver microsomes measured after 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.70nMAssay Description:Competitive displacement of 3[H]retinol from biotinylated RBP4 (unknown origin) by surface plasmon resonance analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of recombinant human CYP2C9 expressed in insect cell microsomes in presence of NADPH-regenerating system after 15 to 45 mins by fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 6.10E+4nMAssay Description:Time dependent inhibition of CYP2D6 in human liver microsomes measured after 30 mins in absence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 4.13nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2021
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/27/2020
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2021
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2021
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 4.13nMAssay Description:The analogs of Compounds 63-162 described herein analogously bind to RBP4 and antagonize retinol-dependent RBP4-TTR interaction. Additional piperidin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.8nMAssay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:The analogs of Compounds 63-162 described herein analogously bind to RBP4 and antagonize retinol-dependent RBP4-TTR interaction. Additional piperidin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMAssay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:The analogs of Compounds 63-162 described herein analogously bind to RBP4 and antagonize retinol-dependent RBP4-TTR interaction. Additional piperidin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMAssay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:The analogs of Compounds 63-162 described herein analogously bind to RBP4 and antagonize retinol-dependent RBP4-TTR interaction. Additional piperidin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMAssay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMpH: 7.5Assay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 9.21nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.73nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.8nMpH: 7.5 T: 2°CAssay Description:TR-FRET assay for retinol-induced RBP4-TTR interaction Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR inte...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMpH: 7.5 T: 2°CAssay Description:TR-FRET assay for retinol-induced RBP4-TTR interaction Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR inte...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 16.1nMpH: 7.5 T: 2°CAssay Description:TR-FRET assay for retinol-induced RBP4-TTR interaction Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR inte...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMpH: 7.5 T: 2°CAssay Description:TR-FRET assay for retinol-induced RBP4-TTR interaction Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR inte...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 4.13nMpH: 7.5Assay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetTransthyretin(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.8nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMpH: 7.5Assay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetTransthyretin(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 4.13nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2017
Entry Details
Go to US Patent

TargetTransthyretin(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMpH: 7.5Assay Description:Binding of a desired RBP4 antagonist displaces retinol and induces hindrance for RBP4-TTR interaction resulting in the decreased FRET signal (FIG. 7)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetTransthyretin(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 12.7nMpH: 7.4 T: 2°CAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2018
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 4.13nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2019
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2019
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2019
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2019
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 4.13nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/27/2020
Entry Details
Go to US Patent

TargetRetinol-binding protein 4(Human)
Columbia University

US Patent
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataIC50: 5.36nMAssay Description:Untagged human RBP4 purified from urine of tubular proteinuria patients was purchased from Fitzgerald Industries International. It was biotinylated u...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/27/2020
Entry Details
Go to US Patent

TargetCytochrome P450 2D6(Human)
Albany College of Pharmacy and Health Sciences

Curated by ChEMBL
LigandPNGBDBM249466(US9434727, 65 | US10072016, Compound 65 | US977701...)
Affinity DataKi:  720nMAssay Description:Time dependent inhibition of CYP2D6 in human liver microsomes assessed as equilibrium inhibition binding constant in presence of NADPH by LC-MS/MS an...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed