BDBM50198218 5-(1-(2-(benzo[d][1,3]dioxol-5-ylmethylamino)ethyl)-1H-pyrazol-3-yl)-N-hydroxythiophene-2-carboxamide::ADS-102550::CHEMBL217716

SMILES ONC(=O)c1ccc(s1)-c1ccn(CCNCc2ccc3OCOc3c2)n1

InChI Key InChIKey=CCCCPSHFLXQUBH-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50198218   

TargetHistone deacetylase 1(Human)
Argenta Discovery

Curated by ChEMBL
LigandPNGBDBM50198218(ADS-102550 | 5-(1-(2-(benzo[d][1,3]dioxol-5-ylmeth...)
Affinity DataIC50: 29nMAssay Description:Inhibition of HDAC activity measured by HDAC Fluorescent Activity Assay (mean of two experiments)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetHistone deacetylase 1(Human)
Argenta Discovery

Curated by ChEMBL
LigandPNGBDBM50198218(ADS-102550 | 5-(1-(2-(benzo[d][1,3]dioxol-5-ylmeth...)
Affinity DataIC50: 29nMAssay Description:Inhibition of HDAC activity measured by HDAC Fluorescent Activity Assay (mean of two experiments)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Menarini Ricerche

Curated by ChEMBL
LigandPNGBDBM50198218(ADS-102550 | 5-(1-(2-(benzo[d][1,3]dioxol-5-ylmeth...)
Affinity DataIC50: 510nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Menarini Ricerche

Curated by ChEMBL
LigandPNGBDBM50198218(ADS-102550 | 5-(1-(2-(benzo[d][1,3]dioxol-5-ylmeth...)
Affinity DataIC50: 5.30E+4nMAssay Description:Inhibition of CYP450 3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed