BDBM50554112 CHEMBL4745955

SMILES CCn1nc2CCCCCc2c1Nc1nc(cs1)-c1ccc(c(OC)n1)-n1cnc(C)c1

InChI Key InChIKey=RJBHTARGFMGGBA-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 = 50554112   

TargetPresenilin-1(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50554112(CHEMBL4745955)
Affinity DataIC50: 32nMAssay Description:Modulation of gamma secretase in human SH-SY5Y cells overexpressing wild type APP751 assessed as inhibition of amyloid beta (35 to 42 residues) forma...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50554112(CHEMBL4745955)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of recombinant CYP3A4 (unknown origin) by fluorescence-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50554112(CHEMBL4745955)
Affinity DataIC50: 3.70E+4nMAssay Description:Inhibition of recombinant CYP2C9 (unknown origin) by fluorescence-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50554112(CHEMBL4745955)
Affinity DataIC50: 8.50E+4nMAssay Description:Inhibition of recombinant CYP2C19 (unknown origin) by fluorescence-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50554112(CHEMBL4745955)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of recombinant CYP1A2 (unknown origin) by fluorescence-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50554112(CHEMBL4745955)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of recombinant CYP2D6 (unknown origin) by fluorescence-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed