BDBM50536192 CHEMBL4570567

SMILES Cc1cc(cc(C)n1)-c1nc(cc(n1)-c1cccnc1)N1CCC(CC1)N1CCOCC1

InChI Key InChIKey=OROGDQDTZRXQRG-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 50536192   

TargetCytochrome P450 1A2(Human)
University of Dundee

Curated by ChEMBL
LigandPNGBDBM50536192(CHEMBL4570567)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human CYP1A2 expressed in Escherichia coli pre-incubated for 5 mins before regenerating cofactor solution addition using Ethoxyresorufi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
University of Dundee

Curated by ChEMBL
LigandPNGBDBM50536192(CHEMBL4570567)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP2C19 expressed in Escherichia coli pre-incubated for 5 mins before regenerating cofactor solution addition using 3-Cyano-7-Eth...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
University of Dundee

Curated by ChEMBL
LigandPNGBDBM50536192(CHEMBL4570567)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of human CYP3A4 expressed in Escherichia coli pre-incubated for 5 mins before regenerating cofactor solution addition using Diethoxyfluore...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
University of Dundee

Curated by ChEMBL
LigandPNGBDBM50536192(CHEMBL4570567)
Affinity DataIC50: 8.20E+4nMAssay Description:Inhibition of human CYP2C9 expressed in Escherichia coli pre-incubated for 5 mins before regenerating cofactor solution addition using 7-methoxy-4-(t...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
University of Dundee

Curated by ChEMBL
LigandPNGBDBM50536192(CHEMBL4570567)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP2D6 expressed in Escherichia coli pre-incubated for 5 mins before regenerating cofactor solution addition using 7-methoxy-4-(a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed