BDBM50249044 CHEMBL4067000

SMILES CC(C)(O)c1cncc(c1)-n1ncc2c(cccc12)C(F)(F)F

InChI Key InChIKey=ANXYCLJRYJHMTA-UHFFFAOYSA-N

Data  9 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 9 hits for monomerid = 50249044   

TargetCytochrome P450 11B1, mitochondrial(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 98nMAssay Description:Inhibition of human CYP11B1-8C7 expressed in Chinese hamster V79 cells using 11-deoxycortisol as substrate preincubated for 1 hr followed by substrat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 4.30E+4nMAssay Description:Inhibition of hepatic CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 9.10E+3nMAssay Description:Inhibition of hepatic CYP2C9 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetCytochrome P450 11B2, mitochondrial(Rat)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 2.20nMAssay Description:Inhibition of rat CYP11B2-1F4 expressed in Chinese hamster V79 cells using 11-deoxycorticosterone as substrate preincubated for 1 hr followed by subs...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 2.80E+3nMAssay Description:Inhibition of hepatic CYP2D6 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetAromatase(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 4.60E+3nMAssay Description:Inhibition of CYP19 (unknown origin) using MFC as substrate and NADPH as cofactor preincubated for 10 mins with cofactor followed by substrate/enzyme...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetSteroid 17-alpha-hydroxylase/17,20 lyase(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human CYP17 expressed in African green monkey COS7 cells using 17-hydroxypregnenolone as substrate preincubated for 1 hr followed by su...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetSteroid 21-hydroxylase(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human CYP21 expressed in African green monkey COS7 cells using 17-hydroxypregnenolone as substrate preincubated for 1 hr followed by su...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed
TargetCytochrome P450 11B2, mitochondrial(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50249044(CHEMBL4067000)
Affinity DataIC50: 2.20nMAssay Description:Inhibition of human CYP11B2-CLE9 expressed in Chinese hamster V79 cells using 11-deoxycorticosterone as substrate preincubated for 1 hr followed by s...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/16/2019
Entry Details Article
PubMed