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Target
Tyrosine-protein phosphatase non-receptor type 1
Ligand
BDBM50243311
Substrate
n/a
Meas. Tech.
ChEMBL_491985 (CHEMBL951535)
IC50
44000±n/a nM
Citation
 Hussain, M; Ahmed, V; Hill, B; Ahmed, Z; Taylor, SD A re-examination of the difluoromethylenesulfonic acid group as a phosphotyrosine mimic for PTP1B inhibition. Bioorg Med Chem 16:6764-77 (2008) [PubMed]  Article 
Target
Name:
Tyrosine-protein phosphatase non-receptor type 1
Synonyms:
PTN1_HUMAN | PTP1B | PTPN1 | Protein tyrosine phosphatase 1B (PTP1B) | Protein tyrosine phosphatase-1B (PTP1B) | Protein-tyrosine phosphatase 1B | Protein-tyrosine phosphatase 1B (PTP1B) | Tyrosine-protein phosphatase non-receptor type 1 | Tyrosine-protein phosphatase non-receptor type 1 (PTP1B)
Type:
Protein phosphatase
Mol. Mass.:
49963.76
Organism:
Homo sapiens (Human)
Description:
Human recombinant GST-fusion PTP1B (1-435).
Residue:
435
Sequence:
MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHEDLEPPPEHIPPPPRPPKRILEPHNGKCREFFPNHQWVKEETQEDKDCPIKEEKGSPLNAAPYGIESMSQDTEVRSRVVGGSLRGAQAASPAKGEPSLPEKDEDHALSYWKPFLVNMCVATVLTAGAYLCYRFLFNSNT
  
Inhibitor
Name:
BDBM50243311
Synonyms:
(S)-4-((S)-2-((S)-2-((S)-2-amino-3-carboxypropanamido)propanamido)-3-carboxypropanamido)-5-((R)-1-((S)-1-amino-4-methyl-1-oxopentan-2-ylamino)-1-oxo-3-(3-(sulfomethyl)phenyl)propan-2-ylamino)-5-oxopentanoic acid | CHEMBL502657
Type:
Small organic molecule
Emp. Form.:
C32H47N7O15S
Mol. Mass.:
801.818
SMILES:
CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc(CS(O)(=O)=O)c1)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 |r|
Structure:
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