BDBM50022077 CHEMBL3109797

SMILES CCc1nc2cc(Cl)ccn2c1C(=O)NCc1ccc(cc1)N1CCN(CC1)c1ccc(F)cc1

InChI Key InChIKey=LJGARRQSIYHDHV-UHFFFAOYSA-N

Data  6 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 6 hits for monomerid = 50022077   

TargetCytochrome P450 3A4(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022077(CHEMBL3109797)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP3A4 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022077(CHEMBL3109797)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP2D6 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022077(CHEMBL3109797)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP1A2 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022077(CHEMBL3109797)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP2C9 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Institut Pasteur Korea

Curated by ChEMBL
LigandPNGBDBM50022077(CHEMBL3109797)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of recombinant CYP2C19 (unknown origin) by LC/MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetDecaprenylphosphoryl-beta-D-ribose oxidase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
The Maharaja Sayajirao University of Baroda

Curated by ChEMBL
LigandPNGBDBM50022077(CHEMBL3109797)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of Mycobacterium tuberculosis H37Rv DprE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMed