BDBM50609928 CHEMBL5279681

SMILES N(c1nc(cs1)-c1nccs1)c1ccc(cc1)-n1ccnc1

InChI Key InChIKey=XWXSDNPGIFGIES-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50609928   

TargetCytochrome P450 1B1(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50609928(CHEMBL5279681)
Affinity DataIC50: 0.0900nMAssay Description:Inhibition of recombinant human CYP1B1 using 7-ethyl-0-resorufin as substrate incubated for 30 mins in presence of NADPH by EROD assayMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCytochrome P450 1A1(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50609928(CHEMBL5279681)
Affinity DataIC50: 11nMAssay Description:Inhibition of recombinant human CYP1A1 using 7-ethyl-0-resorufin as substrate incubated for 30 mins in presence of NADPH by EROD assayMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCytochrome P450 1A2(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50609928(CHEMBL5279681)
Affinity DataIC50: 0.125nMAssay Description:Inhibition of recombinant human CYP1A2 using 7-ethyl-0-resorufin as substrate incubated for 30 mins in presence of NADPH by EROD assayMore data for this Ligand-Target Pair
In DepthDetails
PubMed