Reaction Details Report a problem with these data
Target
Tyrosine-protein phosphatase non-receptor type 1 [1-298]
Ligand
BDBM13448
Substrate
BDBM13432
Meas. Tech.
Phosphatase Inhibition Assay
IC50
120200±n/a nM
Citation
Klopfenstein, SR; Evdokimov, AG; Colson, AO; Fairweather, NT; Neuman, JJ; Maier, MB; Gray, JL; Gerwe, GS; Stake, GE; Howard, BW; Farmer, JA; Pokross, ME; Downs, TR; Kasibhatla, B; Peters, KG 1,2,3,4-Tetrahydroisoquinolinyl sulfamic acids as phosphatase PTP1B inhibitors. Bioorg Med Chem Lett 16:1574-8 (2006) [PubMed] Article
More Info.:
Target
Name:
Tyrosine-protein phosphatase non-receptor type 1 [1-298]
Synonyms:
PTN1_HUMAN | PTP-1B | PTP1B | PTPN1 | PTPase 1B | Protein-Tyrosine Phosphatase 1B (PTP1B) | Tyrosine-protein phosphatase, non-receptor type 1
Type:
Enzyme
Mol. Mass.:
34670.65
Organism:
Homo sapiens (Human)
Description:
The catalytic domain of PTP 1B (residues 1-298) was expressed and purified from E. coli.
Residue:
298
Sequence:
MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHED
Inhibitor
Name:
BDBM13448
Synonyms:
N-[(3S)-3-(benzylcarbamoyl)-2-[(tert-butoxy)carbonyl]-1,2,3,4-tetrahydroisoquinolin-7-yl]sulfamic acid | Tetrahydroisoquinoline (TIQ) deriv. 9b
Type:
Small organic molecule
Emp. Form.:
C22H27N3O6S
Mol. Mass.:
461.531
SMILES:
CC(C)(C)OC(=O)N1Cc2cc(NS(O)(=O)=O)ccc2C[C@H]1C(=O)NCc1ccccc1 |r|