Reaction Details Report a problem with these data
Target
Tyrosine-protein phosphatase non-receptor type 1
Ligand
BDBM50071370
Substrate
n/a
Meas. Tech.
ChEMBL_1466859 (CHEMBL3405965)
IC50
31500±n/a nM
Citation
 Li, JL; Gao, LX; Meng, FW; Tang, CL; Zhang, RJ; Li, JY; Luo, C; Li, J; Zhao, WM PTP1B inhibitors from stems of Angelica keiskei (Ashitaba). Bioorg Med Chem Lett 25:2028-32 (2015) [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:
BDBM50071370
Synonyms:
(3R,8S)-falcarindiol | (3R,8S,)-heptadeca-1,9-dien-4,6-diyne-3,8-diol | (3S,8S)-falcarindiol | (Z)-(3R,8S)-Heptadeca-1,9-diene-4,6-diyne-3,8-diol | (Z)-(3S,8S)-Heptadeca-1,9-diene-4,6-diyne-3,8-diol | CHEMBL69018 | Falcarindiol | Heptadeca-1,9(Z)-diene-4,6-diyne-3,8-diol | Heptadeca-1,9-diene-4,6-diyne-3,8-diol
Type:
Small organic molecule
Emp. Form.:
C17H24O2
Mol. Mass.:
260.3713
SMILES:
CCCCCCC\C=C/[C@H](O)C#CC#C[C@H](O)C=C |r|
Structure:
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