BDBM50243241 CID44560696::PTP1B inhibitor 3::{3-[(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-3-carboxypropanamido]-4-carboxybutanamido]-2-{[(1S)-1-carbamoyl-3-methylbutyl]carbamoyl}ethyl]phenyl}difluoromethanesulfonate

SMILES CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc(c1)C(F)(F)S([O-])(=O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(O)=O)C(N)=O

InChI Key InChIKey=LOBNPUCSAYDFEM-USUWBSJTSA-M

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50243241   

TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))
University Of Waterloo

Curated by ChEMBL
LigandPNGBDBM50243241(CID44560696 | PTP1B inhibitor 3 | {3-[(2R)-2-[(2S)...)
Affinity DataIC50:  1.00E+4nMAssay Description:Inhibition of human PTP1B expressed in Escherichia coli BL21(DE3) cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed