BDBM637669 US11834414, Compound HMC-C-01-A

SMILES C[C@@]3(O)CC[C@@H](NS(=O)(=O)c2ccc(c1ccc(Cl)cc1C#N)cc2)CC3

InChI Key InChIKey=PHOYDFRXZMNHIF-UHFFFAOYSA-N

Data  5 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 10 hits for monomerid = 637669   

TargetCytochrome P450 2D6(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 1.66E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6 and 3A4), 0.1 M phosphate buffer pH 7.4...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2025
Entry Details
US Patent

TargetCytochrome P450 2D6(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 1.66E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6, and 3A4), 0.1 M phosphate buffer pH 7....More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/23/2024
Entry Details
US Patent

TargetCytochrome P450 2C9(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.10E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6, and 3A4), 0.1 M phosphate buffer pH 7....More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/23/2024
Entry Details
US Patent

TargetCytochrome P450 2C9(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.10E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6 and 3A4), 0.1 M phosphate buffer pH 7.4...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2025
Entry Details
US Patent

TargetCytochrome P450 1A2(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.50E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6, and 3A4), 0.1 M phosphate buffer pH 7....More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/23/2024
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.50E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6 and 3A4), 0.1 M phosphate buffer pH 7.4...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2025
Entry Details
US Patent

TargetCytochrome P450 2C19(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.50E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6 and 3A4), 0.1 M phosphate buffer pH 7.4...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2025
Entry Details
US Patent

TargetCytochrome P450 1A2(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.50E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6 and 3A4), 0.1 M phosphate buffer pH 7.4...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2025
Entry Details
US Patent

TargetCytochrome P450 2C19(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.50E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6, and 3A4), 0.1 M phosphate buffer pH 7....More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/23/2024
Entry Details
US Patent

TargetCytochrome P450 3A4(Human)
Modern Biosciences

US Patent
LigandPNGBDBM637669(US11834414, Compound HMC-C-01-A | US12162836, Comp...)
Affinity DataIC50: 2.50E+4nMAssay Description:CYP450 enzymes (final protein 75 pmol/mL for CYP1A2; 12.5 pmol/mL for CYP2C19; and 25 pmol/mL for CYP2C9, 2D6, and 3A4), 0.1 M phosphate buffer pH 7....More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/23/2024
Entry Details
US Patent