BDBM50267701 4-(3-(3-Bromophenyl)thioureido)-N-(5-methylisoxazol-3-yl)benzenesulfonamide::CHEMBL490247

SMILES Cc1cc(NS(=O)(=O)c2ccc(NC(=S)Nc3cccc(Br)c3)cc2)no1

InChI Key InChIKey=QPECIPZOCWPNBP-UHFFFAOYSA-N

Data  2 IC50  2 Kd

  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 4 hits for monomerid = 50267701   

TargetPeptidyl-prolyl cis-trans isomerase A(Human)
Peking University

Curated by ChEMBL
LigandPNGBDBM50267701(4-(3-(3-Bromophenyl)thioureido)-N-(5-methylisoxazo...)
Affinity DataIC50: 450nMAssay Description:Inhibition of human cyclophilin A at 6 degCMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase A(Human)
Peking University

Curated by ChEMBL
LigandPNGBDBM50267701(4-(3-(3-Bromophenyl)thioureido)-N-(5-methylisoxazo...)
Affinity DataKd:  8.86E+4nMAssay Description:Binding affinity to human cyclophilin A by intrinsic tryptophan fluorescence titration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase A(Human)
Peking University

Curated by ChEMBL
LigandPNGBDBM50267701(4-(3-(3-Bromophenyl)thioureido)-N-(5-methylisoxazo...)
Affinity DataKd:  8.86E+4nMAssay Description:Binding affinity to Homo sapiens (human) cyclophilin A expressed in Escherichia coli BL21(DE3) by fluorescence titration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2020
Entry Details Article

TargetPeptidyl-prolyl cis-trans isomerase A(Human)
Peking University

Curated by ChEMBL
LigandPNGBDBM50267701(4-(3-(3-Bromophenyl)thioureido)-N-(5-methylisoxazo...)
Affinity DataIC50: 450nMAssay Description:Inhibition of Homo sapiens (human) cyclophilin A PPIase activity expressed in Escherichia coli BL21(DE3) using Suc-AAPF-pNA as substrate measured aft...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2020
Entry Details Article