BDBM50525275 CHEMBL4540948

SMILES COc1cc(ccc1Nc1ccc(N2CCCCC2)c(Oc2ccc(C)c(NC(=O)C=C)c2)n1)N1CCN(C)CC1

InChI Key InChIKey=ZFRMQNBHXVYHCH-UHFFFAOYSA-N

Data  11 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50525275   

TargetCytochrome P450 2C9(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C9 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCathepsin B(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human C-terminal polyhistidine-tagged cathepsin B (Arg18 to Ile339 residues) expressed in HEK293 cells using Z-Leu-Arg-AMC ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCathepsin S(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of recombinant human C-terminal polyhistidine-tagged cathepsin S (Met1 to Ile331 residues) expressed in HEK293 cells using MCA-Arg-Pro-Lys...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C19 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetDipeptidyl peptidase 1(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 3.40nMAssay Description:Inhibition of cathepsin C in human U937 cells using H-Gly-Phe-AFC as substrate preincubated for 4 hrs followed by substrate addition and measured aft...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP1A2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2D6 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetProcathepsin L(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human C-terminal His6-tagged cathepsin L (Glu113 to Val333 and Ala114 to Val333 residues) expressed in mouse myeloma cells ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetDipeptidyl peptidase 1(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 1.90nMAssay Description:Inhibition of cathepsin C in human THP1 cells using H-Gly-Phe-AFC as substrate preincubated for 4 hrs followed by substrate addition and measured aft...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetDipeptidyl peptidase 1(Human)
National Institute of Biological Sciences (Nibs)

Curated by ChEMBL
LigandPNGBDBM50525275(CHEMBL4540948)
Affinity DataIC50: 17nMAssay Description:Inhibition of CatL-activated recombinant human C-terminal His10-tagged cathepsin C (25 to 463 residues) expressed in mouse myeloma cells using Gly-Ph...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed