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Target
Tyrosine-protein phosphatase non-receptor type 1
Ligand
BDBM50355646
Substrate
n/a
Meas. Tech.
ChEMBL_776872 (CHEMBL1914006)
IC50
73000±n/a nM
Citation
 Sheriff, S; Beno, BR; Zhai, W; Kostich, WA; McDonnell, PA; Kish, K; Goldfarb, V; Gao, M; Kiefer, SE; Yanchunas, J; Huang, Y; Shi, S; Zhu, S; Dzierba, C; Bronson, J; Macor, JE; Appiah, KK; Westphal, RS; O'Connell, J; Gerritz, SW Small molecule receptor protein tyrosine phosphatase¿ (RPTP¿) ligands that inhibit phosphatase activity via perturbation of the tryptophan-proline-aspartate (WPD) loop. J Med Chem 54:6548-62 (2011) [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:
BDBM50355646
Synonyms:
CHEMBL1910962
Type:
Small organic molecule
Emp. Form.:
C21H17Cl2NO6S3
Mol. Mass.:
546.464
SMILES:
COC(=O)c1cc(ccc1OC)S(=O)(=O)NC(=O)c1sccc1SCc1ccc(Cl)c(Cl)c1
Structure:
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