BDBM50557998 CHEMBL4796866

SMILES CC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)c1n[nH]c2ccc(cc12)[N+]([O-])=O)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O

InChI Key InChIKey=SFURQBPBEMKOCL-UHFFFAOYSA-N

Data  2 KI  1 Kd

  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 3 hits for monomerid = 50557998   

TargetTyrosine-protein phosphatase non-receptor type 1(Human)
University of Geneva

Curated by ChEMBL
LigandPNGBDBM50557998(CHEMBL4796866)
Affinity DataKd:  50nMAssay Description:Binding affinity to N-terminal GST-tagged recombinant human PTP1B (1 to 321 residues) expressed in Escherichia coli assessed as dissociation constant...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 1(Human)
University of Geneva

Curated by ChEMBL
LigandPNGBDBM50557998(CHEMBL4796866)
Affinity DataKi:  250nMAssay Description:Inhibition of N-terminal GST-tagged recombinant human PTP1B (1 to 321 residues) expressed in Escherichia coli using DifMup as substrate preincubated ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 2(Human)
University of Geneva

Curated by ChEMBL
LigandPNGBDBM50557998(CHEMBL4796866)
Affinity DataKi: >2.00E+4nMAssay Description:Inhibition of recombinant human TCPTP (1 to 317 residues) expressed in Escherichia coli using DifMup as substrate preincubated for 30 mins followed b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details Article
PubMed