BDBM50557995 CHEMBL4800222

SMILES CCC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)CC1(CCCCC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(N)=O

InChI Key InChIKey=OTTPVCXNNVFAAV-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 = 50557995   

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

Curated by ChEMBL
LigandPNGBDBM50557995(CHEMBL4800222)
Affinity DataKd:  290nMAssay 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
LigandPNGBDBM50557995(CHEMBL4800222)
Affinity DataKi:  1.70E+3nMAssay 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
LigandPNGBDBM50557995(CHEMBL4800222)
Affinity DataKi: >1.00E+5nMAssay 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